sodium (3E)-3-[(4-acetamidophenyl)hydrazinylidene]-6-azanyl-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (3E)-3-[(4-acetamidophenyl)hydrazinylidene]-6-azanyl-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (3E)-3-[(4-acetamidophenyl)hydrazono]-6-amino-4-oxo-naphthalene-2-sulfonate CAS Name: sodium (3E)-3-[(4-acetamidophenyl)hydrazinylidene]-6-amino-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium (3E)-3-[(4-acetamidophenyl)hydrazinylidene]-6-amino-4-oxonaphthalene-2-sulfonate Traditional Name: sodium (3E)-3-[(4-acetamidophenyl)hydrazono]-6-amino-4-keto-naphthalene-2-sulfonate Formula: C18H15N4NaO5S MolecularWeight: 422.39027

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O5S.Na/c1-10(23)20-13-4-6-14(7-5-13)21-22-17-16(28(25,26)27)8-11-2-3-12(19)9-15(11)18(17)24;/h2-9,21H,19H2,1H3,(H,20,23)(H,25,26,27);/q;+1/p-1/b22-17-;