cyclohexyl 4-azanyl-1-(phenylmethyl)piperidine-4-carboxylate; ethanedioic acid

Systemtic Name: cyclohexyl 4-azanyl-1-(phenylmethyl)piperidine-4-carboxylate; ethanedioic acid Openeye Name: cyclohexyl 4-amino-1-benzyl-piperidine-4-carboxylate; oxalic acid CAS Name: 4-amino-1-(phenylmethyl)-4-piperidinecarboxylic acid cyclohexyl ester; oxalic acid IUPAC Name: cyclohexyl 4-amino-1-benzylpiperidine-4-carboxylate; oxalic acid Traditional Name: 4-amino-1-benzyl-isonipecotic acid cyclohexyl ester; oxalic acid Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2(CCN(CC2)CC3=CC=CC=C3)N.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)OC(=O)C2(CCN(CC2)CC3=CC=CC=C3)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H28N2O2.C2H2O4/c20-19(18(22)23-17-9-5-2-6-10-17)11-13-21(14-12-19)15-16-7-3-1-4-8-16;3-1(4)2(5)6/h1,3-4,7-8,17H,2,5-6,9-15,20H2;(H,3,4)(H,5,6)