methyl (E)-2-(hydroxymethyl)-4-[6-oxidanylidene-2-phenyl-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]but-2-enoate

Systemtic Name: methyl (E)-2-(hydroxymethyl)-4-[6-oxidanylidene-2-phenyl-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]but-2-enoate Openeye Name: methyl (E)-4-[5-(benzyloxycarbonylamino)-6-oxo-2-phenyl-pyrimidin-1-yl]-2-(hydroxymethyl)but-2-enoate CAS Name: (E)-2-(hydroxymethyl)-4-[6-oxo-2-phenyl-5-(phenylmethoxycarbonylamino)-1-pyrimidinyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-(hydroxymethyl)-4-[6-oxo-2-phenyl-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]but-2-enoate Traditional Name: (E)-4-[5-(benzyloxycarbonylamino)-6-keto-2-phenyl-pyrimidin-1-yl]-2-methylol-but-2-enoic acid methyl ester Formula: C24H23N3O6 MolecularWeight: 449.45592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CCN1C(=NC=C(C1=O)NC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)CO

Isomeric SMILES

COC(=O)/C(=C/CN1C(=NC=C(C1=O)NC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)/CO

InChI

InChI=1S/C24H23N3O6/c1-32-23(30)19(15-28)12-13-27-21(18-10-6-3-7-11-18)25-14-20(22(27)29)26-24(31)33-16-17-8-4-2-5-9-17/h2-12,14,28H,13,15-16H2,1H3,(H,26,31)/b19-12+