[2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] (2R)-2-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] (2R)-2-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid [2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid [2-keto-2-[3-(2-ketopyrrolidino)phenyl]ethyl] ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC(=CC=C1)N2CCCC2=O)SC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)C1=CC(=CC=C1)N2CCCC2=O)SC3=CC=CC=C3

InChI

InChI=1S/C21H21NO4S/c1-15(27-18-9-3-2-4-10-18)21(25)26-14-19(23)16-7-5-8-17(13-16)22-12-6-11-20(22)24/h2-5,7-10,13,15H,6,11-12,14H2,1H3/t15-/m1/s1