N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide CAS Name: N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide IUPAC Name: N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: N-[(1R,5S)-9-methyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-1H-benzimidazole-4-carboxamide Formula: C17H23N4O+ MolecularWeight: 299.39072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C2CCCC1CC(C2)NC(=O)C3=C4C(=CC=C3)NC=N4

Isomeric SMILES

C[NH+]1[C@@H]2CCC[C@H]1CC(C2)NC(=O)C3=C4C(=CC=C3)NC=N4

InChI

InChI=1S/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)/p+1/t11?,12-,13+