1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(2-methoxyphenyl)methyl]pipecolinic acid Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2OC)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=C2OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C22H27NO3/c1-3-16-11-13-17(14-12-16)21(18-8-4-5-10-20(18)26-2)23-15-7-6-9-19(23)22(24)25/h4-5,8,10-14,19,21H,3,6-7,9,15H2,1-2H3,(H,24,25)