N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)-1-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)-1-(phenylmethyl)piperidine-3-carboxamide Openeye Name: 1-benzyl-N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)piperidine-3-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)-1-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-benzyl-N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)piperidine-3-carboxamide Traditional Name: 1-benzyl-N-(2,4-dimethoxyphenyl)-6-(4-fluorophenyl)nipecotamide Formula: C27H29FN2O3 MolecularWeight: 448.529163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2CCC(N(C2)CC3=CC=CC=C3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2CCC(N(C2)CC3=CC=CC=C3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C27H29FN2O3/c1-32-23-13-14-24(26(16-23)33-2)29-27(31)21-10-15-25(20-8-11-22(28)12-9-20)30(18-21)17-19-6-4-3-5-7-19/h3-9,11-14,16,21,25H,10,15,17-18H2,1-2H3,(H,29,31)