(phenylmethyl) 3-methyl-2-(pyridin-4-ylcarbonylamino)butanoate

Systemtic Name: (phenylmethyl) 3-methyl-2-(pyridin-4-ylcarbonylamino)butanoate Openeye Name: benzyl 3-methyl-2-(pyridine-4-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(pyridin-4-yl)methyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-(pyridine-4-carbonylamino)butanoate Traditional Name: 2-isonicotinamido-3-methyl-butyric acid benzyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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