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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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