diazanium (3E)-7-acetamido-4-oxidanylidene-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate

Systemtic Name: diazanium (3E)-7-acetamido-4-oxidanylidene-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate Openeye Name: diammonium (3E)-7-acetamido-4-oxo-3-[[4-(4-sulfonatophenyl)azophenyl]hydrazono]naphthalene-2-sulfonate CAS Name: diammonium (3E)-7-acetamido-4-oxo-3-[[4-(4-sulfonatophenyl)azophenyl]hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: diazanium (3E)-7-acetamido-4-oxo-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate Traditional Name: diammonium (3E)-7-acetamido-4-keto-3-[[4-(4-sulfonatophenyl)azophenyl]hydrazono]naphthalene-2-sulfonate Formula: C24H25N7O8S2 MolecularWeight: 603.6274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=O)C(=NNC3=CC=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])C(=C2)S(=O)(=O)[O-].[NH4+].[NH4+]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=O)/C(=N\NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-].[NH4+].[NH4+]

InChI

InChI=1S/C24H19N5O8S2.2H3N/c1-14(30)25-19-8-11-21-15(12-19)13-22(39(35,36)37)23(24(21)31)29-28-17-4-2-16(3-5-17)26-27-18-6-9-20(10-7-18)38(32,33)34;;/h2-13,28H,1H3,(H,25,30)(H,32,33,34)(H,35,36,37);2*1H3/b27-26?,29-23-;;