3-methyl-4-methylidene-6-(4-nitrophenyl)-[1,2]oxazolo[3,4-d]pyridazin-6-ium-7-one

Systemtic Name: 3-methyl-4-methylidene-6-(4-nitrophenyl)-[1,2]oxazolo[3,4-d]pyridazin-6-ium-7-one Openeye Name: 3-methyl-4-methylene-6-(4-nitrophenyl)isoxazolo[3,4-d]pyridazin-6-ium-7-one CAS Name: 3-methyl-4-methylene-6-(4-nitrophenyl)-7-isoxazolo[3,4-d]pyridazin-6-iumone IUPAC Name: 3-methyl-4-methylidene-6-(4-nitrophenyl)-[1,2]oxazolo[3,4-d]pyridazin-6-ium-7-one Traditional Name: 3-methyl-4-methylene-6-(4-nitrophenyl)isoxazolo[3,4-d]pyridazin-6-ium-7-one Formula: C13H9N4O4+ MolecularWeight: 285.23496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C)N=[N+](C(=O)C2=NO1)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C)N=[N+](C(=O)C2=NO1)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N4O4/c1-7-11-8(2)21-15-12(11)13(18)16(14-7)9-3-5-10(6-4-9)17(19)20/h3-6H,1H2,2H3/q+1