3-[(3S)-1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid

Systemtic Name: 3-[(3S)-1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid Openeye Name: 3-[(3S)-2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]sulfanylpropanoic acid CAS Name: 3-[[(3S)-1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoic acid IUPAC Name: 3-[(3S)-1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoic acid Traditional Name: 3-[[(3S)-2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]thio]propionic acid Formula: C14H15NO4S MolecularWeight: 293.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)SCCC(=O)O

InChI

InChI=1S/C14H15NO4S/c1-9-2-4-10(5-3-9)15-12(16)8-11(14(15)19)20-7-6-13(17)18/h2-5,11H,6-8H2,1H3,(H,17,18)/t11-/m0/s1