[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl] 2-(4-chlorophenyl)sulfanylacetate CAS Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(2-chloro-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl] 2-(4-chlorophenyl)sulfanylacetate Traditional Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(2-chloro-4-nitro-anilino)-2-keto-ethyl] ester Formula: C16H12Cl2N2O5S MolecularWeight: 415.24788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C16H12Cl2N2O5S/c17-10-1-4-12(5-2-10)26-9-16(22)25-8-15(21)19-14-6-3-11(20(23)24)7-13(14)18/h1-7H,8-9H2,(H,19,21)