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

Systemtic Name: methyl 2-(4-oxidanyl-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)hexanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(N=C(NC1=O)C2=CC=CC=C2)O)C(=O)OC

Isomeric SMILES

CCCCC(C1=C(N=C(NC1=O)C2=CC=CC=C2)O)C(=O)OC

InChI

InChI=1S/C17H20N2O4/c1-3-4-10-12(17(22)23-2)13-15(20)18-14(19-16(13)21)11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3,(H2,18,19,20,21)