2-[2-oxidanylidene-3-(1-phenylethyl)-3-(sulfanylmethyl)pyrrolidin-1-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-3-(1-phenylethyl)-3-(sulfanylmethyl)pyrrolidin-1-yl]ethanoic acid Openeye Name: 2-[2-oxo-3-(1-phenylethyl)-3-(sulfanylmethyl)pyrrolidin-1-yl]acetic acid CAS Name: 2-[3-(mercaptomethyl)-2-oxo-3-(1-phenylethyl)-1-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-oxo-3-(1-phenylethyl)-3-(sulfanylmethyl)pyrrolidin-1-yl]acetic acid Traditional Name: 2-[2-keto-3-(mercaptomethyl)-3-(1-phenylethyl)pyrrolidino]acetic acid Formula: C15H19NO3S MolecularWeight: 293.38126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2(CCN(C2=O)CC(=O)O)CS

Isomeric SMILES

CC(C1=CC=CC=C1)C2(CCN(C2=O)CC(=O)O)CS

InChI

InChI=1S/C15H19NO3S/c1-11(12-5-3-2-4-6-12)15(10-20)7-8-16(14(15)19)9-13(17)18/h2-6,11,20H,7-10H2,1H3,(H,17,18)