(2S)-1-[2-[(4-chlorophenyl)methyl]benzimidazol-1-yl]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[2-[(4-chlorophenyl)methyl]benzimidazol-1-yl]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[2-[(4-chlorophenyl)methyl]benzimidazol-1-yl]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[2-[(4-chlorophenyl)methyl]-1-benzimidazolyl]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[2-[(4-chlorophenyl)methyl]benzimidazol-1-yl]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-[2-(4-chlorobenzyl)benzimidazol-1-yl]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C22H27ClN3O+ MolecularWeight: 384.92228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(CN2C3=CC=CC=C3N=C2CC4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](CN2C3=CC=CC=C3N=C2CC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C22H26ClN3O/c23-18-10-8-17(9-11-18)14-22-24-20-6-2-3-7-21(20)26(22)16-19(27)15-25-12-4-1-5-13-25/h2-3,6-11,19,27H,1,4-5,12-16H2/p+1/t19-/m1/s1