5-(3-methylbutyl)-2-[4-(2-methylprop-2-enoxy)phenyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 5-(3-methylbutyl)-2-[4-(2-methylprop-2-enoxy)phenyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-isopentyl-2-[4-(2-methylallyloxy)phenyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-(3-methylbutyl)-2-[4-(2-methylprop-2-enoxy)phenyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-(3-methylbutyl)-2-[4-(2-methylprop-2-enoxy)phenyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-isoamyl-2-[4-(2-methylallyloxy)phenyl]-1H-pyrimidin-6-one Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC(=C)C)O

Isomeric SMILES

CC(C)CCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC(=C)C)O

InChI

InChI=1S/C19H24N2O3/c1-12(2)5-10-16-18(22)20-17(21-19(16)23)14-6-8-15(9-7-14)24-11-13(3)4/h6-9,12H,3,5,10-11H2,1-2,4H3,(H2,20,21,22,23)