N-(1,3-benzodioxol-5-ylmethyl)-6-(4-fluorophenyl)-1-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-fluorophenyl)-1-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-6-(4-fluorophenyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-fluorophenyl)-1-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-6-(4-fluorophenyl)piperidine-3-carboxamide Traditional Name: 1-benzyl-6-(4-fluorophenyl)-N-piperonyl-nipecotamide Formula: C27H27FN2O3 MolecularWeight: 446.513283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(CC1C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC(N(CC1C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H27FN2O3/c28-23-10-7-21(8-11-23)24-12-9-22(17-30(24)16-19-4-2-1-3-5-19)27(31)29-15-20-6-13-25-26(14-20)33-18-32-25/h1-8,10-11,13-14,22,24H,9,12,15-18H2,(H,29,31)