1-[[4-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]piperidine; ethanedioic acid

Systemtic Name: 1-[[4-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]piperidine; ethanedioic acid Openeye Name: 1-[[4-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]piperidine; oxalic acid CAS Name: 1-[[4-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]piperidine; oxalic acid IUPAC Name: 1-[[4-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]piperidine; oxalic acid Traditional Name: 1-[4-[(3,4-dimethylphenoxy)methyl]benzyl]piperidine; oxalic acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC=C(C=C2)CN3CCCCC3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC=C(C=C2)CN3CCCCC3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27NO.C2H2O4/c1-17-6-11-21(14-18(17)2)23-16-20-9-7-19(8-10-20)15-22-12-4-3-5-13-22;3-1(4)2(5)6/h6-11,14H,3-5,12-13,15-16H2,1-2H3;(H,3,4)(H,5,6)