[5,6-dimethyl-1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]methylazanium

Systemtic Name: [5,6-dimethyl-1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]methylazanium Openeye Name: [5,6-dimethyl-1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]methylammonium CAS Name: [5,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-benzimidazolyl]methylammonium IUPAC Name: [5,6-dimethyl-1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]methylazanium Traditional Name: [5,6-dimethyl-1-(4-nitrobenzyl)benzimidazol-2-yl]methylammonium Formula: C17H19N4O2+ MolecularWeight: 311.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C[NH3+])CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)C[NH3+])CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O2/c1-11-7-15-16(8-12(11)2)20(17(9-18)19-15)10-13-3-5-14(6-4-13)21(22)23/h3-8H,9-10,18H2,1-2H3/p+1