2-azanyl-5-[[4-(2-methylpropoxy)phenyl]methyl]-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-azanyl-5-[[4-(2-methylpropoxy)phenyl]methyl]-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-amino-5-[(4-isobutoxyphenyl)methyl]-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-amino-5-[[4-(2-methylpropoxy)phenyl]methyl]-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-amino-5-[[4-(2-methylpropoxy)phenyl]methyl]-6-oxo-1H-pyrimidin-4-olate Traditional Name: 2-amino-5-(4-isobutoxybenzyl)-6-keto-1H-pyrimidin-4-olate Formula: C15H18N3O3- MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)N)[O-]

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)N)[O-]

InChI

InChI=1S/C15H19N3O3/c1-9(2)8-21-11-5-3-10(4-6-11)7-12-13(19)17-15(16)18-14(12)20/h3-6,9H,7-8H2,1-2H3,(H4,16,17,18,19,20)/p-1