N-(5-chloranyl-2-fluoranyl-phenyl)-1-(3,5-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-fluoranyl-phenyl)-1-(3,5-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-fluoro-phenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide CAS Name: N-(5-chloro-2-fluorophenyl)-1-[(3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-fluorophenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-fluoro-phenyl)-1-(3,5-dimethoxybenzoyl)isonipecotamide Formula: C21H22ClFN2O4 MolecularWeight: 420.861783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)Cl)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)Cl)F)OC

InChI

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