(E)-4-[[4-(4-nitrophenyl)sulfanylphenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[4-(4-nitrophenyl)sulfanylphenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-(4-nitrophenyl)sulfanylanilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-[(4-nitrophenyl)thio]anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-(4-nitrophenyl)sulfanylanilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[4-[(4-nitrophenyl)thio]anilino]but-2-enoic acid Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C=CC(=O)O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)/C=C/C(=O)O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5S/c19-15(9-10-16(20)21)17-11-1-5-13(6-2-11)24-14-7-3-12(4-8-14)18(22)23/h1-10H,(H,17,19)(H,20,21)/b10-9+