diazanium 5-[2-(4-acetamido-2-sulfonato-phenyl)hydrazinyl]-6-azanylidene-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: diazanium 5-[2-(4-acetamido-2-sulfonato-phenyl)hydrazinyl]-6-azanylidene-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: diammonium 5-[2-(4-acetamido-2-sulfonato-phenyl)hydrazino]-6-imino-4-oxo-naphthalene-2-sulfonate CAS Name: diammonium 5-[(4-acetamido-2-sulfonatophenyl)hydrazo]-6-imino-4-oxo-2-naphthalenesulfonate IUPAC Name: diazanium 5-[2-(4-acetamido-2-sulfonatophenyl)hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonate Traditional Name: diammonium 5-[N'-(4-acetamido-2-sulfonato-phenyl)hydrazino]-6-imino-4-keto-naphthalene-2-sulfonate Formula: C18H22N6O8S2 MolecularWeight: 514.53268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=CC2=N)S(=O)(=O)[O-].[NH4+].[NH4+]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=CC2=N)S(=O)(=O)[O-].[NH4+].[NH4+]

InChI

InChI=1S/C18H16N4O8S2.2H3N/c1-9(23)20-11-3-5-14(16(7-11)32(28,29)30)21-22-18-13(19)4-2-10-6-12(31(25,26)27)8-15(24)17(10)18;;/h2-8,19,21-22H,1H3,(H,20,23)(H,25,26,27)(H,28,29,30);2*1H3