ethyl 3-[[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[(3S)-5-oxo-1-propan-2-yl-3-pyrrolidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(3S)-5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 3-[[(3S)-1-isopropyl-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CC(=O)N(C2)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)[C@H]2CC(=O)N(C2)C(C)C

InChI

InChI=1S/C17H22N2O4/c1-4-23-17(22)12-6-5-7-14(8-12)18-16(21)13-9-15(20)19(10-13)11(2)3/h5-8,11,13H,4,9-10H2,1-3H3,(H,18,21)/t13-/m0/s1