4-methyl-5-(4-nitro-5-oxidanylidene-2H-1,2-oxazol-3-yl)pyrimidine-2-carbonitrile

Systemtic Name: 4-methyl-5-(4-nitro-5-oxidanylidene-2H-1,2-oxazol-3-yl)pyrimidine-2-carbonitrile Openeye Name: 4-methyl-5-(4-nitro-5-oxo-2H-isoxazol-3-yl)pyrimidine-2-carbonitrile CAS Name: 4-methyl-5-(4-nitro-5-oxo-2H-isoxazol-3-yl)-2-pyrimidinecarbonitrile IUPAC Name: 4-methyl-5-(4-nitro-5-oxo-2H-1,2-oxazol-3-yl)pyrimidine-2-carbonitrile Traditional Name: 5-(5-keto-4-nitro-3-isoxazolin-3-yl)-4-methyl-pyrimidine-2-carbonitrile Formula: C9H5N5O4 MolecularWeight: 247.1671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C2=C(C(=O)ON2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NC(=NC=C1C2=C(C(=O)ON2)[N+](=O)[O-])C#N

InChI

InChI=1S/C9H5N5O4/c1-4-5(3-11-6(2-10)12-4)7-8(14(16)17)9(15)18-13-7/h3,13H,1H3