(2R)-1-[2-(diphenylmethyl)benzimidazol-1-yl]-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-[2-(diphenylmethyl)benzimidazol-1-yl]-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(2-benzhydrylbenzimidazol-1-yl)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol CAS Name: (2R)-1-[2-(diphenylmethyl)-1-benzimidazolyl]-3-(4-methyl-1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-(2-benzhydrylbenzimidazol-1-yl)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(2-benzhydrylbenzimidazol-1-yl)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol Formula: C29H34N3O+ MolecularWeight: 440.59976

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(CN2C3=CC=CC=C3N=C2C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC1CC[NH+](CC1)C[C@@H](CN2C3=CC=CC=C3N=C2C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C29H33N3O/c1-22-16-18-31(19-17-22)20-25(33)21-32-27-15-9-8-14-26(27)30-29(32)28(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-15,22,25,28,33H,16-21H2,1H3/p+1/t25-/m0/s1