butyl 1-(phenylmethyl)-4-[(phenylmethyl)amino]piperidine-4-carboxylate; ethanedioic acid

Systemtic Name: butyl 1-(phenylmethyl)-4-[(phenylmethyl)amino]piperidine-4-carboxylate; ethanedioic acid Openeye Name: butyl 1-benzyl-4-(benzylamino)piperidine-4-carboxylate; oxalic acid CAS Name: oxalic acid; 1-(phenylmethyl)-4-[(phenylmethyl)amino]-4-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 1-benzyl-4-(benzylamino)piperidine-4-carboxylate; oxalic acid Traditional Name: 1-benzyl-4-(benzylamino)isonipecotic acid butyl ester; oxalic acid Formula: C28H36N2O10 MolecularWeight: 560.59284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)NCC3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)NCC3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H32N2O2.2C2H2O4/c1-2-3-18-28-23(27)24(25-19-21-10-6-4-7-11-21)14-16-26(17-15-24)20-22-12-8-5-9-13-22;2*3-1(4)2(5)6/h4-13,25H,2-3,14-20H2,1H3;2*(H,3,4)(H,5,6)