sodium (3E)-4-oxidanylidene-3-(phenylhydrazinylidene)naphthalene-1-sulfonate

Systemtic Name: sodium (3E)-4-oxidanylidene-3-(phenylhydrazinylidene)naphthalene-1-sulfonate Openeye Name: sodium (3E)-4-oxo-3-(phenylhydrazono)naphthalene-1-sulfonate CAS Name: sodium (3E)-4-oxo-3-(phenylhydrazinylidene)-1-naphthalenesulfonate IUPAC Name: sodium (3E)-4-oxo-3-(phenylhydrazinylidene)naphthalene-1-sulfonate Traditional Name: sodium (3E)-4-keto-3-(phenylhydrazono)naphthalene-1-sulfonate Formula: C16H11N2NaO4S MolecularWeight: 350.32431

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)N/N=C/2\C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C16H12N2O4S.Na/c19-16-13-9-5-4-8-12(13)15(23(20,21)22)10-14(16)18-17-11-6-2-1-3-7-11;/h1-10,17H,(H,20,21,22);/q;+1/p-1/b18-14+;