(phenylmethyl) 3-methyl-2-(pyridin-3-ylcarbonylamino)butanoate

Systemtic Name: (phenylmethyl) 3-methyl-2-(pyridin-3-ylcarbonylamino)butanoate Openeye Name: benzyl 3-methyl-2-(pyridine-3-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(3-pyridinyl)methyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-(pyridine-3-carbonylamino)butanoate Traditional Name: 3-methyl-2-nicotinamido-butyric acid benzyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C18H20N2O3/c1-13(2)16(20-17(21)15-9-6-10-19-11-15)18(22)23-12-14-7-4-3-5-8-14/h3-11,13,16H,12H2,1-2H3,(H,20,21)