1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]acetyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[4-(2-phenylpropan-2-yl)phenoxy]acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(4-cumylphenoxy)acetyl]isonipecotic acid Formula: C23H27NO4 MolecularWeight: 381.46478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C23H27NO4/c1-23(2,18-6-4-3-5-7-18)19-8-10-20(11-9-19)28-16-21(25)24-14-12-17(13-15-24)22(26)27/h3-11,17H,12-16H2,1-2H3,(H,26,27)