2-[5-oxidanylidene-1-[2-(4-phenoxyphenyl)ethyl]pyrrolidin-3-yl]ethanethioate

Systemtic Name: 2-[5-oxidanylidene-1-[2-(4-phenoxyphenyl)ethyl]pyrrolidin-3-yl]ethanethioate Openeye Name: 2-[5-oxo-1-[2-(4-phenoxyphenyl)ethyl]pyrrolidin-3-yl]ethanethioate CAS Name: 2-[5-oxo-1-[2-(4-phenoxyphenyl)ethyl]-3-pyrrolidinyl]ethanethioate IUPAC Name: 2-[5-oxo-1-[2-(4-phenoxyphenyl)ethyl]pyrrolidin-3-yl]ethanethioate Traditional Name: 2-[5-keto-1-[2-(4-phenoxyphenyl)ethyl]pyrrolidin-3-yl]thioacetate Formula: C20H20NO3S- MolecularWeight: 354.4427

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CCC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=S)[O-]

Isomeric SMILES

C1C(CN(C1=O)CCC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=S)[O-]

InChI

InChI=1S/C20H21NO3S/c22-19-12-16(13-20(23)25)14-21(19)11-10-15-6-8-18(9-7-15)24-17-4-2-1-3-5-17/h1-9,16H,10-14H2,(H,23,25)/p-1