[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(4-chloroanilino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-(4-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloroanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(4-chloroanilino)-2-keto-ethyl] ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClNO3S/c18-13-6-8-14(9-7-13)19-16(20)12-22-17(21)10-11-23-15-4-2-1-3-5-15/h1-9H,10-12H2,(H,19,20)