N-butyl-1-[(4-ethylphenyl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide; ethanedioic acid

Systemtic Name: N-butyl-1-[(4-ethylphenyl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide; ethanedioic acid Openeye Name: N-benzyl-N-butyl-1-[(4-ethylphenyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: N-butyl-1-[(4-ethylphenyl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-benzyl-N-butyl-1-[(4-ethylphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: N-benzyl-N-butyl-1-(4-ethylbenzyl)isonipecotamide; oxalic acid Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)CC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)CC.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H36N2O.C2H2O4/c1-3-5-17-28(21-23-9-7-6-8-10-23)26(29)25-15-18-27(19-16-25)20-24-13-11-22(4-2)12-14-24;3-1(4)2(5)6/h6-14,25H,3-5,15-21H2,1-2H3;(H,3,4)(H,5,6)