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

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-phenethyl-pyrrolidin-3-yl]sulfanylbenzoic acid Openeye Name: 2-(2,5-dioxo-1-phenethyl-pyrrolidin-3-yl)sulfanylbenzoic acid CAS Name: 2-[(2,5-dioxo-1-phenethyl-3-pyrrolidinyl)thio]benzoic acid IUPAC Name: 2-(2,5-dioxo-1-phenethylpyrrolidin-3-yl)sulfanylbenzoic acid Traditional Name: 2-[(2,5-diketo-1-phenethyl-pyrrolidin-3-yl)thio]benzoic acid Formula: C19H17NO4S MolecularWeight: 355.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)CCC2=CC=CC=C2)SC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1C(C(=O)N(C1=O)CCC2=CC=CC=C2)SC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H17NO4S/c21-17-12-16(25-15-9-5-4-8-14(15)19(23)24)18(22)20(17)11-10-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,23,24)