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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CC(=O)N(C2)CCC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2CC(=O)N(C2)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O4/c1-28-21(27)17-4-2-3-5-18(17)23-20(26)15-12-19(25)24(13-15)11-10-14-6-8-16(22)9-7-14/h2-9,15H,10-13H2,1H3,(H,23,26)