5,6-dimethyl-4-nitro-1-propyl-benzimidazole

Systemtic Name: 5,6-dimethyl-4-nitro-1-propyl-benzimidazole Openeye Name: 5,6-dimethyl-4-nitro-1-propyl-benzimidazole CAS Name: 5,6-dimethyl-4-nitro-1-propylbenzimidazole IUPAC Name: 5,6-dimethyl-4-nitro-1-propylbenzimidazole Traditional Name: 5,6-dimethyl-4-nitro-1-propyl-benzimidazole Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C=C(C(=C2[N+](=O)[O-])C)C

Isomeric SMILES

CCCN1C=NC2=C1C=C(C(=C2[N+](=O)[O-])C)C

InChI

InChI=1S/C12H15N3O2/c1-4-5-14-7-13-11-10(14)6-8(2)9(3)12(11)15(16)17/h6-7H,4-5H2,1-3H3