disodium 2-[[[3-methoxy-4-[2-methoxy-4-[methyl-(2-sulfonatoethyldiazenyl)amino]phenyl]phenyl]-methyl-amino]diazenyl]ethanesulfonate

Systemtic Name: disodium 2-[[[3-methoxy-4-[2-methoxy-4-[methyl-(2-sulfonatoethyldiazenyl)amino]phenyl]phenyl]-methyl-amino]diazenyl]ethanesulfonate Openeye Name: disodium 2-[3-methoxy-4-[2-methoxy-4-[methyl(2-sulfonatoethylazo)amino]phenyl]-N-methyl-anilino]azoethanesulfonate CAS Name: disodium 2-[3-methoxy-4-[2-methoxy-4-[methyl(2-sulfonatoethylazo)amino]phenyl]-N-methylanilino]azoethanesulfonate IUPAC Name: disodium 2-[[3-methoxy-4-[2-methoxy-4-[methyl-(2-sulfonatoethyldiazenyl)amino]phenyl]-N-methylanilino]diazenyl]ethanesulfonate Traditional Name: disodium 2-[3-methoxy-4-[2-methoxy-4-[methyl(2-sulfonatoethylazo)amino]phenyl]-N-methyl-anilino]azoethanesulfonate Formula: C20H26N6Na2O8S2 MolecularWeight: 588.56538

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=C(C=C1)C2=C(C=C(C=C2)N(C)N=NCCS(=O)(=O)[O-])OC)OC)N=NCCS(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CN(C1=CC(=C(C=C1)C2=C(C=C(C=C2)N(C)N=NCCS(=O)(=O)[O-])OC)OC)N=NCCS(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H28N6O8S2.2Na/c1-25(23-21-9-11-35(27,28)29)15-5-7-17(19(13-15)33-3)18-8-6-16(14-20(18)34-4)26(2)24-22-10-12-36(30,31)32;;/h5-8,13-14H,9-12H2,1-4H3,(H,27,28,29)(H,30,31,32);;/q;2*+1/p-2