N-[(E)-1-(1H-benzimidazol-2-yl)-2-nitro-ethenyl]propan-1-amine

Systemtic Name: N-[(E)-1-(1H-benzimidazol-2-yl)-2-nitro-ethenyl]propan-1-amine Openeye Name: N-[(E)-1-(1H-benzimidazol-2-yl)-2-nitro-vinyl]propan-1-amine CAS Name: N-[(E)-1-(1H-benzimidazol-2-yl)-2-nitroethenyl]-1-propanamine IUPAC Name: N-[(E)-1-(1H-benzimidazol-2-yl)-2-nitroethenyl]propan-1-amine Traditional Name: [(E)-1-(1H-benzimidazol-2-yl)-2-nitro-vinyl]-propyl-amine Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=C[N+](=O)[O-])C1=NC2=CC=CC=C2N1

Isomeric SMILES

CCCN/C(=C/[N+](=O)[O-])/C1=NC2=CC=CC=C2N1

InChI

InChI=1S/C12H14N4O2/c1-2-7-13-11(8-16(17)18)12-14-9-5-3-4-6-10(9)15-12/h3-6,8,13H,2,7H2,1H3,(H,14,15)/b11-8+