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

Systemtic Name: ethanedioic acid; methyl 4-azanyl-1-(phenylmethyl)piperidine-4-carboxylate Openeye Name: methyl 4-amino-1-benzyl-piperidine-4-carboxylate; oxalic acid CAS Name: 4-amino-1-(phenylmethyl)-4-piperidinecarboxylic acid methyl ester; oxalic acid IUPAC Name: methyl 4-amino-1-benzylpiperidine-4-carboxylate; oxalic acid Traditional Name: 4-amino-1-benzyl-isonipecotic acid methyl ester; oxalic acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N.C(=O)(C(=O)O)O

Isomeric SMILES

COC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20N2O2.C2H2O4/c1-18-13(17)14(15)7-9-16(10-8-14)11-12-5-3-2-4-6-12;3-1(4)2(5)6/h2-6H,7-11,15H2,1H3;(H,3,4)(H,5,6)