1-[(2-methoxyphenyl)-(3-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2-methoxyphenyl)-(3-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(2-methoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2-methoxyphenyl)-(3-phenylmethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2-methoxyphenyl)-(3-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(2-methoxyphenyl)methyl]pipecolinic acid Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C27H29NO4/c1-31-25-16-6-5-14-23(25)26(28-17-8-7-15-24(28)27(29)30)21-12-9-13-22(18-21)32-19-20-10-3-2-4-11-20/h2-6,9-14,16,18,24,26H,7-8,15,17,19H2,1H3,(H,29,30)