1-[2-(2,4-dimethylphenoxy)ethyl]-4-(phenylmethyl)piperidine; ethanedioic acid

Systemtic Name: 1-[2-(2,4-dimethylphenoxy)ethyl]-4-(phenylmethyl)piperidine; ethanedioic acid Openeye Name: 4-benzyl-1-[2-(2,4-dimethylphenoxy)ethyl]piperidine; oxalic acid CAS Name: 1-[2-(2,4-dimethylphenoxy)ethyl]-4-(phenylmethyl)piperidine; oxalic acid IUPAC Name: 4-benzyl-1-[2-(2,4-dimethylphenoxy)ethyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-[2-(2,4-dimethylphenoxy)ethyl]piperidine; oxalic acid Formula: C24H31NO5 MolecularWeight: 413.50664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2CCC(CC2)CC3=CC=CC=C3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2CCC(CC2)CC3=CC=CC=C3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H29NO.C2H2O4/c1-18-8-9-22(19(2)16-18)24-15-14-23-12-10-21(11-13-23)17-20-6-4-3-5-7-20;3-1(4)2(5)6/h3-9,16,21H,10-15,17H2,1-2H3;(H,3,4)(H,5,6)