4-[2-cyanoethyl(methyl)amino]benzoic acid

Systemtic Name: 4-[2-cyanoethyl(methyl)amino]benzoic acid Openeye Name: 4-[2-cyanoethyl(methyl)amino]benzoic acid CAS Name: 4-[2-cyanoethyl(methyl)amino]benzoic acid IUPAC Name: 4-[2-cyanoethyl(methyl)amino]benzoic acid Traditional Name: 4-[2-cyanoethyl(methyl)amino]benzoic acid Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O2/c1-13(8-2-7-12)10-5-3-9(4-6-10)11(14)15/h3-6H,2,8H2,1H3,(H,14,15)