[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)N2CCCC2=O

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC(=CC=C1)N2CCCC2=O

InChI

InChI=1S/C17H22N2O4/c1-3-9-18-16(21)12(2)23-17(22)13-6-4-7-14(11-13)19-10-5-8-15(19)20/h4,6-7,11-12H,3,5,8-10H2,1-2H3,(H,18,21)/t12-/m0/s1