2-[2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrolidin-3-yl]sulfanylbenzoic acid

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrolidin-3-yl]sulfanylbenzoic acid Openeye Name: 2-(1-benzyl-2,5-dioxo-pyrrolidin-3-yl)sulfanylbenzoic acid CAS Name: 2-[[2,5-dioxo-1-(phenylmethyl)-3-pyrrolidinyl]thio]benzoic acid IUPAC Name: 2-(1-benzyl-2,5-dioxopyrrolidin-3-yl)sulfanylbenzoic acid Traditional Name: 2-[(1-benzyl-2,5-diketo-pyrrolidin-3-yl)thio]benzoic acid Formula: C18H15NO4S MolecularWeight: 341.381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)CC2=CC=CC=C2)SC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1C(C(=O)N(C1=O)CC2=CC=CC=C2)SC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H15NO4S/c20-16-10-15(24-14-9-5-4-8-13(14)18(22)23)17(21)19(16)11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,22,23)