N-cycloheptyl-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; ethanedioic acid

Systemtic Name: N-cycloheptyl-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; ethanedioic acid Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-N-cycloheptyl-piperidine-4-carboxamide; oxalic acid CAS Name: N-cycloheptyl-1-[(3-phenylmethoxyphenyl)methyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-cycloheptyl-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(3-benzoxybenzyl)-N-cycloheptyl-isonipecotamide; oxalic acid Formula: C29H38N2O6 MolecularWeight: 510.62182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2CCN(CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2CCN(CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H36N2O2.C2H2O4/c30-27(28-25-12-6-1-2-7-13-25)24-15-17-29(18-16-24)20-23-11-8-14-26(19-23)31-21-22-9-4-3-5-10-22;3-1(4)2(5)6/h3-5,8-11,14,19,24-25H,1-2,6-7,12-13,15-18,20-21H2,(H,28,30);(H,3,4)(H,5,6)