1-[3-(2,5-dimethylphenoxy)propyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(2,5-dimethylphenoxy)propyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(2,5-dimethylphenoxy)propyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(2,5-dimethylphenoxy)propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(2,5-dimethylphenoxy)propyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(2,5-dimethylphenoxy)propyl]nipecotic acid Formula: C17H25NO3 MolecularWeight: 291.3853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCN2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCN2CCCC(C2)C(=O)O

InChI

InChI=1S/C17H25NO3/c1-13-6-7-14(2)16(11-13)21-10-4-9-18-8-3-5-15(12-18)17(19)20/h6-7,11,15H,3-5,8-10,12H2,1-2H3,(H,19,20)