5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid

Systemtic Name: 5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid Openeye Name: 5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid CAS Name: 5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid IUPAC Name: 5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid Traditional Name: 5-methyl-2-[4-(2-methylphenoxy)butylamino]benzoic acid Formula: C19H23NO3 MolecularWeight: 313.39082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCCOC2=CC=CC=C2C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCCOC2=CC=CC=C2C)C(=O)O

InChI

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