3-methylbutyl 2-(2-azanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)hexanoate

Systemtic Name: 3-methylbutyl 2-(2-azanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)hexanoate Openeye Name: isopentyl 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanoate CAS Name: 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanoate Traditional Name: 2-(2-amino-4-hydroxy-6-keto-1H-pyrimidin-5-yl)hexanoic acid isoamyl ester Formula: C15H25N3O4 MolecularWeight: 311.3767

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(N=C(NC1=O)N)O)C(=O)OCCC(C)C

Isomeric SMILES

CCCCC(C1=C(N=C(NC1=O)N)O)C(=O)OCCC(C)C

InChI

InChI=1S/C15H25N3O4/c1-4-5-6-10(14(21)22-8-7-9(2)3)11-12(19)17-15(16)18-13(11)20/h9-10H,4-8H2,1-3H3,(H4,16,17,18,19,20)