N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethyl-propyl]piperidine-4-carboxamide CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-[(3-phenylmethoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3-benzoxybenzyl)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]isonipecotamide Formula: C27H39N3O2 MolecularWeight: 437.61746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3)CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3)CN(C)C

InChI

InChI=1S/C27H39N3O2/c1-27(2,21-29(3)4)20-28-26(31)24-13-15-30(16-14-24)18-23-11-8-12-25(17-23)32-19-22-9-6-5-7-10-22/h5-12,17,24H,13-16,18-21H2,1-4H3,(H,28,31)