lithium; sodium; 2-[(2Z)-2-(3-carboxy-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]-5-[(E)-2-[4-[(2E)-2-(3-carboxy-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]-2-sulfonato-phenyl]ethenyl]benzenesulfonate; 2-[2-hydroxyethyl(methyl)amino]ethanol

Systemtic Name: lithium; sodium; 2-[(2Z)-2-(3-carboxy-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]-5-[(E)-2-[4-[(2E)-2-(3-carboxy-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]-2-sulfonato-phenyl]ethenyl]benzenesulfonate; 2-[2-hydroxyethyl(methyl)amino]ethanol Openeye Name: lithium; sodium; 2-[(2Z)-2-(3-carboxy-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]-5-[(E)-2-[4-[(2E)-2-(3-carboxy-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]-2-sulfonato-phenyl]vinyl]benzenesulfonate; 2-[2-hydroxyethyl(methyl)amino]ethanol CAS Name: lithium; sodium; 2-[(2Z)-2-(3-carboxy-5-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]-5-[(E)-2-[4-[(2E)-2-(3-carboxy-5-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]-2-sulfonatophenyl]ethenyl]benzenesulfonate; 2-[2-hydroxyethyl(methyl)amino]ethanol IUPAC Name: lithium; sodium; 2-[(2Z)-2-(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]-5-[(E)-2-[4-[(2E)-2-(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]-2-sulfonatophenyl]ethenyl]benzenesulfonate; 2-[2-hydroxyethyl(methyl)amino]ethanol Traditional Name: lithium; sodium; 2-[(N'Z)-N'-(3-carboxy-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]-5-[(E)-2-[4-[(N'E)-N'-(3-carboxy-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]-2-sulfonato-phenyl]vinyl]besylate; 2-[2-hydroxyethyl(methyl)amino]ethanol Formula: C35H35LiN5NaO14S2 MolecularWeight: 843.73827

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC(=NNC2=CC(=C(C=C2)C=CC3=CC(=C(C=C3)NN=C4C=C(C(=O)C(=C4)C(=O)O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C=C(C1=O)C(=O)O.CN(CCO)CCO.[Na+]

Isomeric SMILES

[Li+].CC1=C/C(=N\NC2=CC(=C(C=C2)/C=C/C3=CC(=C(C=C3)N/N=C\4/C=C(C(=O)C(=C4)C(=O)O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])/C=C(C1=O)C(=O)O.CN(CCO)CCO.[Na+]

InChI

InChI=1S/C30H24N4O12S2.C5H13NO2.Li.Na/c1-15-9-20(12-22(27(15)35)29(37)38)32-31-19-7-6-18(25(14-19)47(41,42)43)5-3-17-4-8-24(26(11-17)48(44,45)46)34-33-21-10-16(2)28(36)23(13-21)30(39)40;1-6(2-4-7)3-5-8;;/h3-14,31,34H,1-2H3,(H,37,38)(H,39,40)(H,41,42,43)(H,44,45,46);7-8H,2-5H2,1H3;;/q;;2*+1/p-2/b5-3+,32-20+,33-21-;;;