3-(2-methyl-6-oxidanylidene-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one

Systemtic Name: 3-(2-methyl-6-oxidanylidene-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one Openeye Name: 3-(2-methyl-6-oxo-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one CAS Name: 3-(2-methyl-6-oxo-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one IUPAC Name: 3-(2-methyl-6-oxo-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one Traditional Name: 3-(6-keto-2-methyl-2,3-dihydropyran-4-yl)-5-nitro-1H-benzimidazol-2-one Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=O)O1)N2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O

Isomeric SMILES

CC1CC(=CC(=O)O1)N2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O

InChI

InChI=1S/C13H11N3O5/c1-7-4-9(6-12(17)21-7)15-11-5-8(16(19)20)2-3-10(11)14-13(15)18/h2-3,5-7H,4H2,1H3,(H,14,18)