N-[5-[(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]-6-oxidanylidene-1H-pyrimidin-2-yl]nitramide

Systemtic Name: N-[5-[(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]-6-oxidanylidene-1H-pyrimidin-2-yl]nitramide Openeye Name: N-[5-[(6-methyl-1-oxido-pyridin-1-ium-3-yl)methyl]-6-oxo-1H-pyrimidin-2-yl]nitramide CAS Name: N-[5-[(6-methyl-1-oxido-3-pyridin-1-iumyl)methyl]-6-oxo-1H-pyrimidin-2-yl]nitramide IUPAC Name: N-[5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-6-oxo-1H-pyrimidin-2-yl]nitramide Traditional Name: N-[6-keto-5-[(6-methyl-1-oxido-pyridin-1-ium-3-yl)methyl]-1H-pyrimidin-2-yl]nitramide Formula: C11H11N5O4 MolecularWeight: 277.23614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)CC2=CN=C(NC2=O)N[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)CC2=CN=C(NC2=O)N[N+](=O)[O-])[O-]

InChI

InChI=1S/C11H11N5O4/c1-7-2-3-8(6-15(7)18)4-9-5-12-11(13-10(9)17)14-16(19)20/h2-3,5-6H,4H2,1H3,(H2,12,13,14,17)