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

Systemtic Name: 1-[(4-ethylphenyl)-phenyl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-phenyl-methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-phenylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-phenylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-phenyl-methyl]isonipecotic acid Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C21H25NO2/c1-2-16-8-10-18(11-9-16)20(17-6-4-3-5-7-17)22-14-12-19(13-15-22)21(23)24/h3-11,19-20H,2,12-15H2,1H3,(H,23,24)