4-[4,6-dimethoxy-2-(1-methyl-5-nitro-imidazol-2-yl)pyrimidin-5-yl]butan-2-one

Systemtic Name: 4-[4,6-dimethoxy-2-(1-methyl-5-nitro-imidazol-2-yl)pyrimidin-5-yl]butan-2-one Openeye Name: 4-[4,6-dimethoxy-2-(1-methyl-5-nitro-imidazol-2-yl)pyrimidin-5-yl]butan-2-one CAS Name: 4-[4,6-dimethoxy-2-(1-methyl-5-nitro-2-imidazolyl)-5-pyrimidinyl]-2-butanone IUPAC Name: 4-[4,6-dimethoxy-2-(1-methyl-5-nitroimidazol-2-yl)pyrimidin-5-yl]butan-2-one Traditional Name: 4-[4,6-dimethoxy-2-(1-methyl-5-nitro-imidazol-2-yl)pyrimidin-5-yl]butan-2-one Formula: C14H17N5O5 MolecularWeight: 335.31528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C(N=C(N=C1OC)C2=NC=C(N2C)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)CCC1=C(N=C(N=C1OC)C2=NC=C(N2C)[N+](=O)[O-])OC

InChI

InChI=1S/C14H17N5O5/c1-8(20)5-6-9-13(23-3)16-11(17-14(9)24-4)12-15-7-10(18(12)2)19(21)22/h7H,5-6H2,1-4H3