sodium (4Z)-7-acetamido-4-[(5-methyl-3-nitro-2-oxidanyl-phenyl)hydrazinylidene]-3-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: sodium (4Z)-7-acetamido-4-[(5-methyl-3-nitro-2-oxidanyl-phenyl)hydrazinylidene]-3-oxidanylidene-naphthalene-1-sulfonate Openeye Name: sodium (4Z)-7-acetamido-4-[(2-hydroxy-5-methyl-3-nitro-phenyl)hydrazono]-3-oxo-naphthalene-1-sulfonate CAS Name: sodium (4Z)-7-acetamido-4-[(2-hydroxy-5-methyl-3-nitrophenyl)hydrazinylidene]-3-oxo-1-naphthalenesulfonate IUPAC Name: sodium (4Z)-7-acetamido-4-[(2-hydroxy-5-methyl-3-nitrophenyl)hydrazinylidene]-3-oxonaphthalene-1-sulfonate Traditional Name: sodium (4Z)-7-acetamido-4-[(2-hydroxy-5-methyl-3-nitro-phenyl)hydrazono]-3-keto-naphthalene-1-sulfonate Formula: C19H15N4NaO8S MolecularWeight: 482.39917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])O)NN=C2C3=C(C=C(C=C3)NC(=O)C)C(=CC2=O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])O)N/N=C\2/C3=C(C=C(C=C3)NC(=O)C)C(=CC2=O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C19H16N4O8S.Na/c1-9-5-14(19(26)15(6-9)23(27)28)21-22-18-12-4-3-11(20-10(2)24)7-13(12)17(8-16(18)25)32(29,30)31;/h3-8,21,26H,1-2H3,(H,20,24)(H,29,30,31);/q;+1/p-1/b22-18-;