(3S)-N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-chloro-2,5-dimethoxy-phenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(4-chloro-2,5-dimethoxyphenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-chloro-2,5-dimethoxyphenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(4-chloro-2,5-dimethoxy-phenyl)-1-[2-(4-fluorophenyl)ethyl]-5-keto-pyrrolidine-3-carboxamide Formula: C21H22ClFN2O4 MolecularWeight: 420.861783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CC(=O)N(C2)CCC3=CC=C(C=C3)F)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)[C@H]2CC(=O)N(C2)CCC3=CC=C(C=C3)F)OC)Cl

InChI

InChI=1S/C21H22ClFN2O4/c1-28-18-11-17(19(29-2)10-16(18)22)24-21(27)14-9-20(26)25(12-14)8-7-13-3-5-15(23)6-4-13/h3-6,10-11,14H,7-9,12H2,1-2H3,(H,24,27)/t14-/m0/s1