ethanedioic acid; N-methyl-1-[(2-nitrophenyl)methyl]-N-(phenylmethyl)piperidin-4-amine

Systemtic Name: ethanedioic acid; N-methyl-1-[(2-nitrophenyl)methyl]-N-(phenylmethyl)piperidin-4-amine Openeye Name: N-benzyl-N-methyl-1-[(2-nitrophenyl)methyl]piperidin-4-amine; oxalic acid CAS Name: N-methyl-1-[(2-nitrophenyl)methyl]-N-(phenylmethyl)-4-piperidinamine; oxalic acid IUPAC Name: N-benzyl-N-methyl-1-[(2-nitrophenyl)methyl]piperidin-4-amine; oxalic acid Traditional Name: benzyl-methyl-[1-(2-nitrobenzyl)-4-piperidyl]amine; oxalic acid Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CN(CC1=CC=CC=C1)C2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25N3O2.C2H2O4/c1-21(15-17-7-3-2-4-8-17)19-11-13-22(14-12-19)16-18-9-5-6-10-20(18)23(24)25;3-1(4)2(5)6/h2-10,19H,11-16H2,1H3;(H,3,4)(H,5,6)