1-[(3-propan-2-ylphenyl)carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-propan-2-ylphenyl)carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-isopropylphenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[oxo-(3-propan-2-ylanilino)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-propan-2-ylphenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-(m-cumenylcarbamoyl)nipecotic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H22N2O3/c1-11(2)12-5-3-7-14(9-12)17-16(21)18-8-4-6-13(10-18)15(19)20/h3,5,7,9,11,13H,4,6,8,10H2,1-2H3,(H,17,21)(H,19,20)