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

Systemtic Name: 4-[1-(4-cyanophenyl)ethylamino]-3-methyl-benzoic acid Openeye Name: 4-[1-(4-cyanophenyl)ethylamino]-3-methyl-benzoic acid CAS Name: 4-[1-(4-cyanophenyl)ethylamino]-3-methylbenzoic acid IUPAC Name: 4-[1-(4-cyanophenyl)ethylamino]-3-methylbenzoic acid Traditional Name: 4-[1-(4-cyanophenyl)ethylamino]-3-methyl-benzoic acid Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H16N2O2/c1-11-9-15(17(20)21)7-8-16(11)19-12(2)14-5-3-13(10-18)4-6-14/h3-9,12,19H,1-2H3,(H,20,21)