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

Systemtic Name: propan-2-yl 4-[[(3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[(3S)-1-(2-fluorophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(2-fluorophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(3S)-1-(2-fluorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-(2-fluorophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid isopropyl ester Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3F

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3F

InChI

InChI=1S/C21H21FN2O4/c1-13(2)28-21(27)14-7-9-16(10-8-14)23-20(26)15-11-19(25)24(12-15)18-6-4-3-5-17(18)22/h3-10,13,15H,11-12H2,1-2H3,(H,23,26)/t15-/m0/s1