2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid

Systemtic Name: 2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid Openeye Name: 2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid CAS Name: 2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid IUPAC Name: 2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid Traditional Name: 2-[4-(2,6-dimethylphenoxy)butylamino]benzoic acid Formula: C19H23NO3 MolecularWeight: 313.39082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCNC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCNC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H23NO3/c1-14-8-7-9-15(2)18(14)23-13-6-5-12-20-17-11-4-3-10-16(17)19(21)22/h3-4,7-11,20H,5-6,12-13H2,1-2H3,(H,21,22)