2-methyl-5,6-dinitro-1-(piperidin-1-ylmethyl)benzimidazole

Systemtic Name: 2-methyl-5,6-dinitro-1-(piperidin-1-ylmethyl)benzimidazole Openeye Name: 2-methyl-5,6-dinitro-1-(1-piperidylmethyl)benzimidazole CAS Name: 2-methyl-5,6-dinitro-1-(1-piperidinylmethyl)benzimidazole IUPAC Name: 2-methyl-5,6-dinitro-1-(piperidin-1-ylmethyl)benzimidazole Traditional Name: 2-methyl-5,6-dinitro-1-(piperidinomethyl)benzimidazole Formula: C14H17N5O4 MolecularWeight: 319.31588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2N1CN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC(=C(C=C2N1CN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O4/c1-10-15-11-7-13(18(20)21)14(19(22)23)8-12(11)17(10)9-16-5-3-2-4-6-16/h7-8H,2-6,9H2,1H3