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

Systemtic Name: 1-[(3-methoxyphenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)-(m-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-(3-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-methoxyphenyl)-(m-tolyl)methyl]pipecolinic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)OC)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H25NO3/c1-15-7-5-8-16(13-15)20(17-9-6-10-18(14-17)25-2)22-12-4-3-11-19(22)21(23)24/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3,(H,23,24)