3-[[methyl-[4-(2-methylpropyl)phenyl]amino]methyl]benzoic acid

Systemtic Name: 3-[[methyl-[4-(2-methylpropyl)phenyl]amino]methyl]benzoic acid Openeye Name: 3-[(4-isobutyl-N-methyl-anilino)methyl]benzoic acid CAS Name: 3-[[N-methyl-4-(2-methylpropyl)anilino]methyl]benzoic acid IUPAC Name: 3-[[N-methyl-4-(2-methylpropyl)anilino]methyl]benzoic acid Traditional Name: 3-[(4-isobutyl-N-methyl-anilino)methyl]benzoic acid Formula: C19H23NO2 MolecularWeight: 297.39142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)N(C)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)N(C)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C19H23NO2/c1-14(2)11-15-7-9-18(10-8-15)20(3)13-16-5-4-6-17(12-16)19(21)22/h4-10,12,14H,11,13H2,1-3H3,(H,21,22)