1,5,6-trimethyl-2-(2-methyl-2-nitro-propyl)benzimidazole-4,7-dione

Systemtic Name: 1,5,6-trimethyl-2-(2-methyl-2-nitro-propyl)benzimidazole-4,7-dione Openeye Name: 1,5,6-trimethyl-2-(2-methyl-2-nitro-propyl)benzimidazole-4,7-dione CAS Name: 1,5,6-trimethyl-2-(2-methyl-2-nitropropyl)benzimidazole-4,7-dione IUPAC Name: 1,5,6-trimethyl-2-(2-methyl-2-nitropropyl)benzimidazole-4,7-dione Traditional Name: 1,5,6-trimethyl-2-(2-methyl-2-nitro-propyl)benzimidazole-4,7-quinone Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)N=C(N2C)CC(C)(C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)N=C(N2C)CC(C)(C)[N+](=O)[O-])C

InChI

InChI=1S/C14H17N3O4/c1-7-8(2)13(19)11-10(12(7)18)15-9(16(11)5)6-14(3,4)17(20)21/h6H2,1-5H3