N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-fluorobenzoyl)isonipecotamide Formula: C24H29FN2O3 MolecularWeight: 412.497063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H29FN2O3/c1-24(2,3)18-7-10-21(30-4)20(15-18)26-22(28)16-11-13-27(14-12-16)23(29)17-5-8-19(25)9-6-17/h5-10,15-16H,11-14H2,1-4H3,(H,26,28)