1-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-isopropyl-2-methoxy-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-methoxy-5-propan-2-ylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-methoxy-5-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(5-isopropyl-2-methoxy-benzyl)isonipecotic acid Formula: C17H25NO3 MolecularWeight: 291.3853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C17H25NO3/c1-12(2)14-4-5-16(21-3)15(10-14)11-18-8-6-13(7-9-18)17(19)20/h4-5,10,12-13H,6-9,11H2,1-3H3,(H,19,20)