hexyl 2-[4-oxidanyl-6-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]ethanoate

Systemtic Name: hexyl 2-[4-oxidanyl-6-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]ethanoate Openeye Name: hexyl 2-(2-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)acetate CAS Name: 2-[4-hydroxy-6-oxo-2-(phenylmethyl)-1H-pyrimidin-5-yl]acetic acid hexyl ester IUPAC Name: hexyl 2-(2-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)acetate Traditional Name: 2-(2-benzyl-4-hydroxy-6-keto-1H-pyrimidin-5-yl)acetic acid hexyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC1=C(N=C(NC1=O)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCOC(=O)CC1=C(N=C(NC1=O)CC2=CC=CC=C2)O

InChI

InChI=1S/C19H24N2O4/c1-2-3-4-8-11-25-17(22)13-15-18(23)20-16(21-19(15)24)12-14-9-6-5-7-10-14/h5-7,9-10H,2-4,8,11-13H2,1H3,(H2,20,21,23,24)