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

Systemtic Name: [(1S)-1-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]azanium Openeye Name: [(1S)-1-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]ammonium CAS Name: [(1S)-1-[1-[(4-nitrophenyl)methyl]-2-benzimidazolyl]ethyl]ammonium IUPAC Name: [(1S)-1-[1-[(4-nitrophenyl)methyl]benzimidazol-2-yl]ethyl]azanium Traditional Name: [(1S)-1-[1-(4-nitrobenzyl)benzimidazol-2-yl]ethyl]ammonium Formula: C16H17N4O2+ MolecularWeight: 297.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)[N+](=O)[O-])[NH3+]

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)[N+](=O)[O-])[NH3+]

InChI

InChI=1S/C16H16N4O2/c1-11(17)16-18-14-4-2-3-5-15(14)19(16)10-12-6-8-13(9-7-12)20(21)22/h2-9,11H,10,17H2,1H3/p+1/t11-/m0/s1