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

Systemtic Name: 4-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzoic acid Openeye Name: 4-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzoic acid CAS Name: 4-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzoic acid IUPAC Name: 4-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzoic acid Traditional Name: 4-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzoic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)CCOC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CN(CCC#N)CCOC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H16N2O3/c1-15(8-2-7-14)9-10-18-12-5-3-11(4-6-12)13(16)17/h3-6H,2,8-10H2,1H3,(H,16,17)