[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylsulfanyl]ethanoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylsulfanyl]ethanoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 2-[(2-chlorophenyl)methylsulfanyl]acetate CAS Name: 2-[(2-chlorophenyl)methylthio]acetic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 2-[(2-chlorophenyl)methylsulfanyl]acetate Traditional Name: 2-[(2-chlorobenzyl)thio]acetic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C17H15ClN2O5S MolecularWeight: 394.8294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O5S/c18-15-7-2-1-4-12(15)10-26-11-17(22)25-9-16(21)19-13-5-3-6-14(8-13)20(23)24/h1-8H,9-11H2,(H,19,21)