2-(3-methyl-3-nitro-butyl)-1H-benzimidazole

Systemtic Name: 2-(3-methyl-3-nitro-butyl)-1H-benzimidazole Openeye Name: 2-(3-methyl-3-nitro-butyl)-1H-benzimidazole CAS Name: 2-(3-methyl-3-nitrobutyl)-1H-benzimidazole IUPAC Name: 2-(3-methyl-3-nitrobutyl)-1H-benzimidazole Traditional Name: 2-(3-methyl-3-nitro-butyl)-1H-benzimidazole Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=NC2=CC=CC=C2N1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CCC1=NC2=CC=CC=C2N1)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O2/c1-12(2,15(16)17)8-7-11-13-9-5-3-4-6-10(9)14-11/h3-6H,7-8H2,1-2H3,(H,13,14)