6-chloranyl-2-[(3S)-piperidin-1-ium-3-yl]-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-[(3S)-piperidin-1-ium-3-yl]-1H-benzimidazole Openeye Name: 6-chloro-2-[(3S)-piperidin-1-ium-3-yl]-1H-benzimidazole CAS Name: 6-chloro-2-[(3S)-3-piperidin-1-iumyl]-1H-benzimidazole IUPAC Name: 6-chloro-2-[(3S)-piperidin-1-ium-3-yl]-1H-benzimidazole Traditional Name: 6-chloro-2-[(3S)-piperidin-1-ium-3-yl]-1H-benzimidazole Formula: C12H15ClN3+ MolecularWeight: 236.7206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C12H14ClN3/c13-9-3-4-10-11(6-9)16-12(15-10)8-2-1-5-14-7-8/h3-4,6,8,14H,1-2,5,7H2,(H,15,16)/p+1/t8-/m0/s1