1-[(2,3-dimethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,3-dimethoxyphenyl)-phenylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)-phenylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,3-dimethoxyphenyl)-phenyl-methyl]isonipecotic acid Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C21H25NO4/c1-25-18-10-6-9-17(20(18)26-2)19(15-7-4-3-5-8-15)22-13-11-16(12-14-22)21(23)24/h3-10,16,19H,11-14H2,1-2H3,(H,23,24)