5-butyl-2-[4-(2-methylpropoxy)phenyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 5-butyl-2-[4-(2-methylpropoxy)phenyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-butyl-4-hydroxy-2-(4-isobutoxyphenyl)-1H-pyrimidin-6-one CAS Name: 5-butyl-4-hydroxy-2-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-6-one IUPAC Name: 5-butyl-4-hydroxy-2-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-6-one Traditional Name: 5-butyl-4-hydroxy-2-(4-isobutoxyphenyl)-1H-pyrimidin-6-one Formula: C18H24N2O3 MolecularWeight: 316.39476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC(C)C)O

Isomeric SMILES

CCCCC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC(C)C)O

InChI

InChI=1S/C18H24N2O3/c1-4-5-6-15-17(21)19-16(20-18(15)22)13-7-9-14(10-8-13)23-11-12(2)3/h7-10,12H,4-6,11H2,1-3H3,(H2,19,20,21,22)