1-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide; ethanedioic acid

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide; ethanedioic acid Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-N-(2-pyridylmethyl)piperidine-4-carboxamide; oxalic acid CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-N-(2-pyridinylmethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(2,5-dimethoxybenzyl)-N-(2-pyridylmethyl)isonipecotamide; oxalic acid Formula: C23H29N3O7 MolecularWeight: 459.49226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCC(CC2)C(=O)NCC3=CC=CC=N3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCC(CC2)C(=O)NCC3=CC=CC=N3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27N3O3.C2H2O4/c1-26-19-6-7-20(27-2)17(13-19)15-24-11-8-16(9-12-24)21(25)23-14-18-5-3-4-10-22-18;3-1(4)2(5)6/h3-7,10,13,16H,8-9,11-12,14-15H2,1-2H3,(H,23,25);(H,3,4)(H,5,6)