sodium (5Z)-5-[(4-aminocarbonylphenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (5Z)-5-[(4-aminocarbonylphenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (5Z)-5-[(4-carbamoylphenyl)hydrazono]-6-oxo-naphthalene-2-sulfonate CAS Name: sodium (5Z)-5-[(4-carbamoylphenyl)hydrazinylidene]-6-oxo-2-naphthalenesulfonate IUPAC Name: sodium (5Z)-5-[(4-carbamoylphenyl)hydrazinylidene]-6-oxonaphthalene-2-sulfonate Traditional Name: sodium (5Z)-5-[(4-carbamoylphenyl)hydrazono]-6-keto-naphthalene-2-sulfonate Formula: C17H12N3NaO5S MolecularWeight: 393.34905

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H13N3O5S.Na/c18-17(22)10-1-4-12(5-2-10)19-20-16-14-7-6-13(26(23,24)25)9-11(14)3-8-15(16)21;/h1-9,19H,(H2,18,22)(H,23,24,25);/q;+1/p-1/b20-16-;