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

Systemtic Name: 1-[(4-ethylphenyl)-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(1-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(1-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-naphthalen-1-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(1-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=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)O

InChI

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