N-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorobenzyl)isonipecotamide Formula: C21H25FN2O3 MolecularWeight: 372.433203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H25FN2O3/c1-26-19-8-7-18(13-20(19)27-2)23-21(25)16-9-11-24(12-10-16)14-15-3-5-17(22)6-4-15/h3-8,13,16H,9-12,14H2,1-2H3,(H,23,25)