1-[(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethoxyphenyl)-(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-methoxyphenyl)-p-phenetyl-methyl]nipecotic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C22H27NO4/c1-3-27-20-12-8-17(9-13-20)21(16-6-10-19(26-2)11-7-16)23-14-4-5-18(15-23)22(24)25/h6-13,18,21H,3-5,14-15H2,1-2H3,(H,24,25)