1-[(2-ethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-ethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-ethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-ethoxyphenyl)-phenylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-ethoxyphenyl)-phenylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[o-phenetyl(phenyl)methyl]isonipecotic acid Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C21H25NO3/c1-2-25-19-11-7-6-10-18(19)20(16-8-4-3-5-9-16)22-14-12-17(13-15-22)21(23)24/h3-11,17,20H,2,12-15H2,1H3,(H,23,24)