2,4-bis(azanyl)-5-[2-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid

Systemtic Name: 2,4-bis(azanyl)-5-[2-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Openeye Name: 2,4-diamino-5-[2-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]benzenesulfonic acid CAS Name: 2,4-diamino-5-[2-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 2,4-diamino-5-[2-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 2,4-diamino-5-[N'-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)hydrazino]besylic acid Formula: C12H11N5O6S MolecularWeight: 353.31064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=NNC2=CC(=C(C=C2N)N)S(=O)(=O)O)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C(=NNC2=CC(=C(C=C2N)N)S(=O)(=O)O)C=C1[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O6S/c13-7-4-8(14)12(24(21,22)23)5-9(7)15-16-10-3-6(17(19)20)1-2-11(10)18/h1-5,15H,13-14H2,(H,21,22,23)