[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-methylsulfinylbenzoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-methylsulfinylbenzoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] 4-methylsulfinylbenzoate CAS Name: 4-methylsulfinylbenzoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] 4-methylsulfinylbenzoate Traditional Name: 4-methylsulfinylbenzoic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C16H14N2O6S MolecularWeight: 362.35716

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O6S/c1-25(23)12-8-6-11(7-9-12)16(20)24-10-15(19)17-13-4-2-3-5-14(13)18(21)22/h2-9H,10H2,1H3,(H,17,19)