N-(4-butan-2-ylphenyl)-1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)-1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-oxo-N-(4-sec-butylphenyl)pyrrolidine-3-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-1-(3-chloro-4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-1-(3-chloro-4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-keto-N-(4-sec-butylphenyl)pyrrolidine-3-carboxamide Formula: C21H22ClFN2O2 MolecularWeight: 388.862983

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H22ClFN2O2/c1-3-13(2)14-4-6-16(7-5-14)24-21(27)15-10-20(26)25(12-15)17-8-9-19(23)18(22)11-17/h4-9,11,13,15H,3,10,12H2,1-2H3,(H,24,27)