3-[[propan-2-yl(propyl)amino]methyl]benzoic acid

Systemtic Name: 3-[[propan-2-yl(propyl)amino]methyl]benzoic acid Openeye Name: 3-[[isopropyl(propyl)amino]methyl]benzoic acid CAS Name: 3-[[propan-2-yl(propyl)amino]methyl]benzoic acid IUPAC Name: 3-[[propan-2-yl(propyl)amino]methyl]benzoic acid Traditional Name: 3-[[isopropyl(propyl)amino]methyl]benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC(=C1)C(=O)O)C(C)C

Isomeric SMILES

CCCN(CC1=CC=CC(=C1)C(=O)O)C(C)C

InChI

InChI=1S/C14H21NO2/c1-4-8-15(11(2)3)10-12-6-5-7-13(9-12)14(16)17/h5-7,9,11H,4,8,10H2,1-3H3,(H,16,17)