5-azanyl-4-methyl-3-(2-methylpropyl)-1-oxidanidyl-pyrimidin-1-ium-2-one

Systemtic Name: 5-azanyl-4-methyl-3-(2-methylpropyl)-1-oxidanidyl-pyrimidin-1-ium-2-one Openeye Name: 5-amino-3-isobutyl-4-methyl-1-oxido-pyrimidin-1-ium-2-one CAS Name: 5-amino-4-methyl-3-(2-methylpropyl)-1-oxido-2-pyrimidin-1-iumone IUPAC Name: 5-amino-4-methyl-3-(2-methylpropyl)-1-oxidopyrimidin-1-ium-2-one Traditional Name: 5-amino-3-isobutyl-4-methyl-1-oxido-pyrimidin-1-ium-2-one Formula: C9H15N3O2 MolecularWeight: 197.2343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[N+](C(=O)N1CC(C)C)[O-])N

Isomeric SMILES

CC1=C(C=[N+](C(=O)N1CC(C)C)[O-])N

InChI

InChI=1S/C9H15N3O2/c1-6(2)4-11-7(3)8(10)5-12(14)9(11)13/h5-6H,4,10H2,1-3H3