1-[(3-ethoxy-4-methoxy-phenyl)-(4-methylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-methoxy-phenyl)-(4-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-ethoxy-4-methoxy-phenyl)-(p-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-methoxyphenyl)-(4-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-methoxyphenyl)-(4-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-ethoxy-4-methoxy-phenyl)-(p-tolyl)methyl]pipecolinic acid Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC=C(C=C2)C)N3CCCCC3C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC=C(C=C2)C)N3CCCCC3C(=O)O)OC

InChI

InChI=1S/C23H29NO4/c1-4-28-21-15-18(12-13-20(21)27-3)22(17-10-8-16(2)9-11-17)24-14-6-5-7-19(24)23(25)26/h8-13,15,19,22H,4-7,14H2,1-3H3,(H,25,26)