sodium 4-azanyl-3-[[4-[4-[(2E)-2-(2-oxidanylidene-8-sulfo-naphthalen-1-ylidene)hydrazinyl]phenyl]phenyl]diazenyl]naphthalene-1-sulfonate

Systemtic Name: sodium 4-azanyl-3-[[4-[4-[(2E)-2-(2-oxidanylidene-8-sulfo-naphthalen-1-ylidene)hydrazinyl]phenyl]phenyl]diazenyl]naphthalene-1-sulfonate Openeye Name: sodium 4-amino-3-[4-[4-[(2E)-2-(2-oxo-8-sulfo-1-naphthylidene)hydrazino]phenyl]phenyl]azo-naphthalene-1-sulfonate CAS Name: sodium 4-amino-3-[4-[4-[(2E)-2-(2-oxo-8-sulfo-1-naphthalenylidene)hydrazinyl]phenyl]phenyl]azo-1-naphthalenesulfonate IUPAC Name: sodium 4-amino-3-[[4-[4-[(2E)-2-(2-oxo-8-sulfonaphthalen-1-ylidene)hydrazinyl]phenyl]phenyl]diazenyl]naphthalene-1-sulfonate Traditional Name: sodium 4-amino-3-[4-[4-[(N'E)-N'-(2-keto-8-sulfo-1-naphthylidene)hydrazino]phenyl]phenyl]azo-naphthalene-1-sulfonate Formula: C32H22N5NaO7S2 MolecularWeight: 675.66615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)NN=C5C(=O)C=CC6=C5C(=CC=C6)S(=O)(=O)O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N/N=C\5/C(=O)C=CC6=C5C(=CC=C6)S(=O)(=O)O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C32H23N5O7S2.Na/c33-31-25-6-2-1-5-24(25)29(46(42,43)44)18-26(31)36-34-22-13-8-19(9-14-22)20-10-15-23(16-11-20)35-37-32-27(38)17-12-21-4-3-7-28(30(21)32)45(39,40)41;/h1-18,35H,33H2,(H,39,40,41)(H,42,43,44);/q;+1/p-1/b36-34?,37-32-;