5-[(2Z)-2-(7-azanyl-1-oxidanylidene-3-sulfo-naphthalen-2-ylidene)hydrazinyl]-8-[(2-carboxy-5-sulfo-phenyl)diazenyl]naphthalene-2-carboxylic acid

Systemtic Name: 5-[(2Z)-2-(7-azanyl-1-oxidanylidene-3-sulfo-naphthalen-2-ylidene)hydrazinyl]-8-[(2-carboxy-5-sulfo-phenyl)diazenyl]naphthalene-2-carboxylic acid Openeye Name: 5-[(2Z)-2-(7-amino-1-oxo-3-sulfo-2-naphthylidene)hydrazino]-8-(2-carboxy-5-sulfo-phenyl)azo-naphthalene-2-carboxylic acid CAS Name: 5-[(2Z)-2-(7-amino-1-oxo-3-sulfo-2-naphthalenylidene)hydrazinyl]-8-(2-carboxy-5-sulfophenyl)azo-2-naphthalenecarboxylic acid IUPAC Name: 5-[(2Z)-2-(7-amino-1-oxo-3-sulfonaphthalen-2-ylidene)hydrazinyl]-8-[(2-carboxy-5-sulfophenyl)diazenyl]naphthalene-2-carboxylic acid Traditional Name: 5-[(N'Z)-N'-(7-amino-1-keto-3-sulfo-2-naphthylidene)hydrazino]-8-(2-carboxy-5-sulfo-phenyl)azo-2-naphthoic acid Formula: C28H19N5O11S2 MolecularWeight: 665.60736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2C=C1C(=O)O)N=NC3=C(C=CC(=C3)S(=O)(=O)O)C(=O)O)NN=C4C(=CC5=C(C4=O)C=C(C=C5)N)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2C=C1C(=O)O)N=NC3=C(C=CC(=C3)S(=O)(=O)O)C(=O)O)N/N=C/4\C(=CC5=C(C4=O)C=C(C=C5)N)S(=O)(=O)O

InChI

InChI=1S/C28H19N5O11S2/c29-15-3-1-13-10-24(46(42,43)44)25(26(34)19(13)11-15)33-31-21-7-8-22(20-9-14(27(35)36)2-5-17(20)21)30-32-23-12-16(45(39,40)41)4-6-18(23)28(37)38/h1-12,31H,29H2,(H,35,36)(H,37,38)(H,39,40,41)(H,42,43,44)/b32-30?,33-25+