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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H17NO4S/c1-12(13-7-3-2-4-8-13)20-17(21)11-16(18(20)22)25-15-10-6-5-9-14(15)19(23)24/h2-10,12,16H,11H2,1H3,(H,23,24)