N-cycloheptyl-1-(phenylmethyl)piperidine-4-carboxamide; ethanedioic acid

Systemtic Name: N-cycloheptyl-1-(phenylmethyl)piperidine-4-carboxamide; ethanedioic acid Openeye Name: 1-benzyl-N-cycloheptyl-piperidine-4-carboxamide; oxalic acid CAS Name: N-cycloheptyl-1-(phenylmethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-benzyl-N-cycloheptylpiperidine-4-carboxamide; oxalic acid Traditional Name: 1-benzyl-N-cycloheptyl-isonipecotamide; oxalic acid Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O.C2H2O4/c23-20(21-19-10-6-1-2-7-11-19)18-12-14-22(15-13-18)16-17-8-4-3-5-9-17;3-1(4)2(5)6/h3-5,8-9,18-19H,1-2,6-7,10-16H2,(H,21,23);(H,3,4)(H,5,6)