3-imidazol-1-ylpropyl-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[(1S)-1-(1-methyl-2-benzimidazolyl)ethyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]ammonium Formula: C16H22N5+ MolecularWeight: 284.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1C)[NH2+]CCCN3C=CN=C3

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1C)[NH2+]CCCN3C=CN=C3

InChI

InChI=1S/C16H21N5/c1-13(18-8-5-10-21-11-9-17-12-21)16-19-14-6-3-4-7-15(14)20(16)2/h3-4,6-7,9,11-13,18H,5,8,10H2,1-2H3/p+1/t13-/m0/s1