1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-(2-methylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-(2-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3,5-dimethoxy-phenyl)-(o-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-(2-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-(2-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3,5-dimethoxy-phenyl)-(o-tolyl)methyl]pipecolinic acid Formula: C29H33NO5 MolecularWeight: 475.57602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)N4CCCCC4C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC)N4CCCCC4C(=O)O

InChI

InChI=1S/C29H33NO5/c1-20-11-7-8-14-23(20)27(30-16-10-9-15-24(30)29(31)32)22-17-25(33-2)28(26(18-22)34-3)35-19-21-12-5-4-6-13-21/h4-8,11-14,17-18,24,27H,9-10,15-16,19H2,1-3H3,(H,31,32)