sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: sodium (3Z)-7-acetamido-3-[(4-acetamidophenyl)hydrazono]-4-keto-naphthalene-2-sulfonate Formula: C20H17N4NaO6S MolecularWeight: 464.42695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H18N4O6S.Na/c1-11(25)21-14-3-5-15(6-4-14)23-24-19-18(31(28,29)30)10-13-9-16(22-12(2)26)7-8-17(13)20(19)27;/h3-10,23H,1-2H3,(H,21,25)(H,22,26)(H,28,29,30);/q;+1/p-1/b24-19+;