1-[(3-ethoxyphenyl)-naphthalen-1-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-ethoxyphenyl)-naphthalen-1-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-ethoxyphenyl)-(1-naphthyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-ethoxyphenyl)-(1-naphthalenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-ethoxyphenyl)-naphthalen-1-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[m-phenetyl(1-naphthyl)methyl]nipecotic acid Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC(C4)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC(C4)C(=O)O

InChI

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