methyl-[2-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]azanium

Systemtic Name: methyl-[2-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]azanium Openeye Name: methyl-[2-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]ammonium CAS Name: methyl-[2-[1-[(4-nitrophenyl)methyl]-2-benzimidazolyl]ethyl]ammonium IUPAC Name: methyl-[2-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]azanium Traditional Name: methyl-[2-[1-(4-nitrobenzyl)benzimidazol-2-yl]ethyl]ammonium Formula: C17H19N4O2+ MolecularWeight: 311.35836

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH2+]CCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O2/c1-18-11-10-17-19-15-4-2-3-5-16(15)20(17)12-13-6-8-14(9-7-13)21(22)23/h2-9,18H,10-12H2,1H3/p+1