bis[(6-nitro-1H-benzimidazol-2-yl)methyl]-prop-2-enyl-azanium

Systemtic Name: bis[(6-nitro-1H-benzimidazol-2-yl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-bis[(6-nitro-1H-benzimidazol-2-yl)methyl]ammonium CAS Name: bis[(6-nitro-1H-benzimidazol-2-yl)methyl]-prop-2-enylammonium IUPAC Name: bis[(6-nitro-1H-benzimidazol-2-yl)methyl]-prop-2-enylazanium Traditional Name: allyl-bis[(6-nitro-1H-benzimidazol-2-yl)methyl]ammonium Formula: C19H18N7O4+ MolecularWeight: 408.39072

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=NC2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C=CC[NH+](CC1=NC2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N7O4/c1-2-7-24(10-18-20-14-5-3-12(25(27)28)8-16(14)22-18)11-19-21-15-6-4-13(26(29)30)9-17(15)23-19/h2-6,8-9H,1,7,10-11H2,(H,20,22)(H,21,23)/p+1