1-[1-(2,4,5-trimethoxyphenyl)propyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(2,4,5-trimethoxyphenyl)propyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(2,4,5-trimethoxyphenyl)propyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(2,4,5-trimethoxyphenyl)propyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(2,4,5-trimethoxyphenyl)propyl]piperidine-4-carboxylic acid Traditional Name: 1-(1-asarylpropyl)isonipecotic acid Formula: C18H27NO5 MolecularWeight: 337.41068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1OC)OC)OC)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCC(C1=CC(=C(C=C1OC)OC)OC)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C18H27NO5/c1-5-14(19-8-6-12(7-9-19)18(20)21)13-10-16(23-3)17(24-4)11-15(13)22-2/h10-12,14H,5-9H2,1-4H3,(H,20,21)