ethanedioic acid; 4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]piperidine

Systemtic Name: ethanedioic acid; 4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]piperidine Openeye Name: 4-benzyl-1-[(3,4,5-trimethoxyphenyl)methyl]piperidine; oxalic acid CAS Name: oxalic acid; 4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]piperidine IUPAC Name: 4-benzyl-1-[(3,4,5-trimethoxyphenyl)methyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-(3,4,5-trimethoxybenzyl)piperidine; oxalic acid Formula: C24H31NO7 MolecularWeight: 445.50544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCC(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCC(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H29NO3.C2H2O4/c1-24-20-14-19(15-21(25-2)22(20)26-3)16-23-11-9-18(10-12-23)13-17-7-5-4-6-8-17;3-1(4)2(5)6/h4-8,14-15,18H,9-13,16H2,1-3H3;(H,3,4)(H,5,6)