propyl 4-[[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[(3S)-5-oxo-1-propan-2-yl-3-pyrrolidinyl]methyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[(3S)-5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-isopropyl-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid propyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O4/c1-4-9-24-18(23)13-5-7-15(8-6-13)19-17(22)14-10-16(21)20(11-14)12(2)3/h5-8,12,14H,4,9-11H2,1-3H3,(H,19,22)/t14-/m0/s1