2-[[(phenylmethyl)amino]methyl]-4-pyridin-2-yl-butanoic acid

Systemtic Name: 2-[[(phenylmethyl)amino]methyl]-4-pyridin-2-yl-butanoic acid Openeye Name: 2-[(benzylamino)methyl]-4-(2-pyridyl)butanoic acid CAS Name: 2-[[(phenylmethyl)amino]methyl]-4-(2-pyridinyl)butanoic acid IUPAC Name: 2-[(benzylamino)methyl]-4-pyridin-2-ylbutanoic acid Traditional Name: 2-[(benzylamino)methyl]-4-(2-pyridyl)butyric acid Formula: C17H20N2O2 MolecularWeight: 284.3529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(CCC2=CC=CC=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC(CCC2=CC=CC=N2)C(=O)O

InChI

InChI=1S/C17H20N2O2/c20-17(21)15(9-10-16-8-4-5-11-19-16)13-18-12-14-6-2-1-3-7-14/h1-8,11,15,18H,9-10,12-13H2,(H,20,21)