2-[2-(2-oxidanylidene-3,6-disulfo-naphthalen-1-ylidene)hydrazinyl]benzoic acid; sodium

Systemtic Name: 2-[2-(2-oxidanylidene-3,6-disulfo-naphthalen-1-ylidene)hydrazinyl]benzoic acid; sodium Openeye Name: 2-[2-(2-oxo-3,6-disulfo-1-naphthylidene)hydrazino]benzoic acid; sodium CAS Name: 2-[2-(2-oxo-3,6-disulfo-1-naphthalenylidene)hydrazinyl]benzoic acid; sodium IUPAC Name: 2-[2-(2-oxo-3,6-disulfonaphthalen-1-ylidene)hydrazinyl]benzoic acid; sodium Traditional Name: 2-[N'-(2-keto-3,6-disulfo-1-naphthylidene)hydrazino]benzoic acid; sodium Formula: C17H12N2NaO9S2 MolecularWeight: 475.40495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NN=C2C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NN=C2C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O.[Na]

InChI

InChI=1S/C17H12N2O9S2.Na/c20-16-14(30(26,27)28)8-9-7-10(29(23,24)25)5-6-11(9)15(16)19-18-13-4-2-1-3-12(13)17(21)22;/h1-8,18H,(H,21,22)(H,23,24,25)(H,26,27,28);