2-[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]sulfanylethanoic acid Openeye Name: 2-[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]sulfanylacetic acid CAS Name: 2-[[2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]thio]acetic acid IUPAC Name: 2-[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]sulfanylacetic acid Traditional Name: 2-[[2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]thio]acetic acid Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1SCC(=O)O)CCCC2=CC=CC=C2

Isomeric SMILES

C1CN(C(=O)C1SCC(=O)O)CCCC2=CC=CC=C2

InChI

InChI=1S/C15H19NO3S/c17-14(18)11-20-13-8-10-16(15(13)19)9-4-7-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,17,18)