N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C27H35FN2O4 MolecularWeight: 470.576203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)OCC

InChI

InChI=1S/C27H35FN2O4/c1-5-33-23-12-9-21(17-24(23)34-6-2)25(18(3)4)29-26(31)19-13-15-30(16-14-19)27(32)20-7-10-22(28)11-8-20/h7-12,17-19,25H,5-6,13-16H2,1-4H3,(H,29,31)