2-methyl-4-(5-oxidanylpyridin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 2-methyl-4-(5-oxidanylpyridin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-4-(5-hydroxy-2-pyridyl)-2-methyl-butanoic acid CAS Name: 4-(5-hydroxy-2-pyridinyl)-2-methyl-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4-(5-hydroxypyridin-2-yl)-2-methyl-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-4-(5-hydroxy-2-pyridyl)-2-methyl-butyric acid Formula: C18H20N2O5 MolecularWeight: 344.3618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NC=C(C=C1)O)(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(CCC1=NC=C(C=C1)O)(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O5/c1-18(16(22)23,10-9-14-7-8-15(21)11-19-14)20-17(24)25-12-13-5-3-2-4-6-13/h2-8,11,21H,9-10,12H2,1H3,(H,20,24)(H,22,23)