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

Systemtic Name: 1-[(4-ethoxyphenyl)-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethoxyphenyl)-(1-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethoxyphenyl)-(1-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethoxyphenyl)-naphthalen-1-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-naphthyl(p-phenetyl)methyl]isonipecotic acid Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C25H27NO3/c1-2-29-21-12-10-19(11-13-21)24(26-16-14-20(15-17-26)25(27)28)23-9-5-7-18-6-3-4-8-22(18)23/h3-13,20,24H,2,14-17H2,1H3,(H,27,28)