2-chloranyl-6-[2-cyanoethyl(methyl)amino]benzoic acid

Systemtic Name: 2-chloranyl-6-[2-cyanoethyl(methyl)amino]benzoic acid Openeye Name: 2-chloro-6-[2-cyanoethyl(methyl)amino]benzoic acid CAS Name: 2-chloro-6-[2-cyanoethyl(methyl)amino]benzoic acid IUPAC Name: 2-chloro-6-[2-cyanoethyl(methyl)amino]benzoic acid Traditional Name: 2-chloro-6-[2-cyanoethyl(methyl)amino]benzoic acid Formula: C11H11ClN2O2 MolecularWeight: 238.67024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=C(C(=CC=C1)Cl)C(=O)O

Isomeric SMILES

CN(CCC#N)C1=C(C(=CC=C1)Cl)C(=O)O

InChI

InChI=1S/C11H11ClN2O2/c1-14(7-3-6-13)9-5-2-4-8(12)10(9)11(15)16/h2,4-5H,3,7H2,1H3,(H,15,16)