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

Systemtic Name: 1-[(4-ethylphenyl)-naphthalen-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(2-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(2-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-naphthalen-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(2-naphthyl)methyl]isonipecotic acid Formula: C25H27NO2 MolecularWeight: 373.48738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCC(CC4)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C25H27NO2/c1-2-18-7-9-20(10-8-18)24(26-15-13-21(14-16-26)25(27)28)23-12-11-19-5-3-4-6-22(19)17-23/h3-12,17,21,24H,2,13-16H2,1H3,(H,27,28)