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

Systemtic Name: 3-[1-(3-chlorophenyl)ethylamino]-4-methyl-benzoic acid Openeye Name: 3-[1-(3-chlorophenyl)ethylamino]-4-methyl-benzoic acid CAS Name: 3-[1-(3-chlorophenyl)ethylamino]-4-methylbenzoic acid IUPAC Name: 3-[1-(3-chlorophenyl)ethylamino]-4-methylbenzoic acid Traditional Name: 3-[1-(3-chlorophenyl)ethylamino]-4-methyl-benzoic acid Formula: C16H16ClNO2 MolecularWeight: 289.75674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO2/c1-10-6-7-13(16(19)20)9-15(10)18-11(2)12-4-3-5-14(17)8-12/h3-9,11,18H,1-2H3,(H,19,20)