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2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-5-nitro-imidazol-3-ium-1-yl]ethanol

2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-5-nitro-imidazol-3-ium-1-yl]ethanol

Systemtic Name:2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-5-nitro-imidazol-3-ium-1-yl]ethanol
Openeye Name:2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-5-nitro-imidazol-3-ium-1-yl]ethanol
CAS Name:2-[3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-2-methyl-5-nitro-1-imidazol-3-iumyl]ethanol
IUPAC Name:2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methyl-5-nitroimidazol-3-ium-1-yl]ethanol
Traditional Name:2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-5-nitro-imidazol-3-ium-1-yl]ethanol
Formula: C12H17N6O3+
MolecularWeight: 293.30178
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)C[N+]2=C(N(C(=C2)[N+](=O)[O-])CCO)C


Isomeric SMILES

CC1=NC=C(C(=N1)N)C[N+]2=C(N(C(=C2)[N+](=O)[O-])CCO)C


InChI

InChI=1S/C12H17N6O3/c1-8-14-5-10(12(13)15-8)6-16-7-11(18(20)21)17(3-4-19)9(16)2/h5,7,19H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1


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