disodium (3Z)-5-methyl-6-oxidanylidene-3-[[4-[(3-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: disodium (3Z)-5-methyl-6-oxidanylidene-3-[[4-[(3-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate Openeye Name: disodium (3Z)-5-methyl-6-oxo-3-[[4-(3-sulfonatophenyl)azo-1-naphthyl]hydrazono]cyclohexa-1,4-diene-1-carboxylate CAS Name: disodium (3Z)-5-methyl-6-oxo-3-[[4-(3-sulfonatophenyl)azo-1-naphthalenyl]hydrazinylidene]-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: disodium (3Z)-5-methyl-6-oxo-3-[[4-[(3-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate Traditional Name: disodium (3Z)-6-keto-5-methyl-3-[[4-(3-sulfonatophenyl)azo-1-naphthyl]hydrazono]cyclohexa-1,4-diene-1-carboxylate Formula: C24H16N4Na2O6S MolecularWeight: 534.45158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])C=C(C1=O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C/C(=N/NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])/C=C(C1=O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H18N4O6S.2Na/c1-14-11-16(13-20(23(14)29)24(30)31)26-28-22-10-9-21(18-7-2-3-8-19(18)22)27-25-15-5-4-6-17(12-15)35(32,33)34;;/h2-13,28H,1H3,(H,30,31)(H,32,33,34);;/q;2*+1/p-2/b26-16-,27-25?;;