2-[(2,4-dimethylphenyl)methyl]-5-heptyl-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-5-heptyl-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-5-heptyl-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-(2,4-dimethylbenzyl)-5-heptyl-4-hydroxy-1H-pyrimidin-6-one Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

Isomeric SMILES

CCCCCCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

InChI

InChI=1S/C20H28N2O2/c1-4-5-6-7-8-9-17-19(23)21-18(22-20(17)24)13-16-11-10-14(2)12-15(16)3/h10-12H,4-9,13H2,1-3H3,(H2,21,22,23,24)