hexyl 4-(4-oxidanyl-6-oxidanylidene-2-phenyl-1,3-diazinan-5-yl)butanoate

Systemtic Name: hexyl 4-(4-oxidanyl-6-oxidanylidene-2-phenyl-1,3-diazinan-5-yl)butanoate Openeye Name: hexyl 4-(4-hydroxy-6-oxo-2-phenyl-hexahydropyrimidin-5-yl)butanoate CAS Name: 4-(4-hydroxy-6-oxo-2-phenyl-1,3-diazinan-5-yl)butanoic acid hexyl ester IUPAC Name: hexyl 4-(4-hydroxy-6-oxo-2-phenyl-1,3-diazinan-5-yl)butanoate Traditional Name: 4-(4-hydroxy-6-keto-2-phenyl-hexahydropyrimidin-5-yl)butyric acid hexyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC1C(NC(NC1=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCOC(=O)CCCC1C(NC(NC1=O)C2=CC=CC=C2)O

InChI

InChI=1S/C20H30N2O4/c1-2-3-4-8-14-26-17(23)13-9-12-16-19(24)21-18(22-20(16)25)15-10-6-5-7-11-15/h5-7,10-11,16,18-19,21,24H,2-4,8-9,12-14H2,1H3,(H,22,25)