ethyl (E)-7-[2,4-di(propan-2-yl)-6-pyridin-4-yl-pyrimidin-5-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: ethyl (E)-7-[2,4-di(propan-2-yl)-6-pyridin-4-yl-pyrimidin-5-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoate Openeye Name: ethyl (E)-7-[2,4-diisopropyl-6-(4-pyridyl)pyrimidin-5-yl]-5-hydroxy-3-oxo-hept-6-enoate CAS Name: (E)-7-[2,4-di(propan-2-yl)-6-pyridin-4-yl-5-pyrimidinyl]-5-hydroxy-3-oxo-6-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[2,4-di(propan-2-yl)-6-pyridin-4-ylpyrimidin-5-yl]-5-hydroxy-3-oxohept-6-enoate Traditional Name: (E)-7-[2,4-diisopropyl-6-(4-pyridyl)pyrimidin-5-yl]-5-hydroxy-3-keto-hept-6-enoic acid ethyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(C=CC1=C(N=C(N=C1C(C)C)C(C)C)C2=CC=NC=C2)O

Isomeric SMILES

CCOC(=O)CC(=O)CC(/C=C/C1=C(N=C(N=C1C(C)C)C(C)C)C2=CC=NC=C2)O

InChI

InChI=1S/C24H31N3O4/c1-6-31-21(30)14-19(29)13-18(28)7-8-20-22(15(2)3)26-24(16(4)5)27-23(20)17-9-11-25-12-10-17/h7-12,15-16,18,28H,6,13-14H2,1-5H3/b8-7+