3-chloranyl-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid

Systemtic Name: 3-chloranyl-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid Openeye Name: 3-chloro-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid CAS Name: 3-chloro-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid IUPAC Name: 3-chloro-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid Traditional Name: 3-chloro-2-[2-(2,6-dimethylphenoxy)ethylamino]benzoic acid Formula: C17H18ClNO3 MolecularWeight: 319.78272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCNC2=C(C=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCNC2=C(C=CC=C2Cl)C(=O)O

InChI

InChI=1S/C17H18ClNO3/c1-11-5-3-6-12(2)16(11)22-10-9-19-15-13(17(20)21)7-4-8-14(15)18/h3-8,19H,9-10H2,1-2H3,(H,20,21)