hexyl 2-(4-oxidanyl-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)hexanoate

Systemtic Name: hexyl 2-(4-oxidanyl-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)hexanoate Openeye Name: hexyl 2-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)hexanoate CAS Name: 2-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)hexanoic acid hexyl ester IUPAC Name: hexyl 2-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)hexanoate Traditional Name: 2-(4-hydroxy-6-keto-2-phenyl-1H-pyrimidin-5-yl)hexanoic acid hexyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CCCC)C1=C(N=C(NC1=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCOC(=O)C(CCCC)C1=C(N=C(NC1=O)C2=CC=CC=C2)O

InChI

InChI=1S/C22H30N2O4/c1-3-5-7-11-15-28-22(27)17(14-6-4-2)18-20(25)23-19(24-21(18)26)16-12-9-8-10-13-16/h8-10,12-13,17H,3-7,11,14-15H2,1-2H3,(H2,23,24,25,26)