3-[1-(3,4-dichlorophenyl)ethylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[1-(3,4-dichlorophenyl)ethylamino]-4-methyl-benzoic acid Openeye Name: 3-[1-(3,4-dichlorophenyl)ethylamino]-4-methyl-benzoic acid CAS Name: 3-[1-(3,4-dichlorophenyl)ethylamino]-4-methylbenzoic acid IUPAC Name: 3-[1-(3,4-dichlorophenyl)ethylamino]-4-methylbenzoic acid Traditional Name: 3-[1-(3,4-dichlorophenyl)ethylamino]-4-methyl-benzoic acid Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(C)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(C)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H15Cl2NO2/c1-9-3-4-12(16(20)21)8-15(9)19-10(2)11-5-6-13(17)14(18)7-11/h3-8,10,19H,1-2H3,(H,20,21)