butyl-[(2R)-3-[2-(diphenylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: butyl-[(2R)-3-[2-(diphenylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2R)-3-(2-benzhydrylbenzimidazol-1-yl)-2-hydroxy-propyl]-butyl-methyl-ammonium CAS Name: butyl-[(2R)-3-[2-(diphenylmethyl)-1-benzimidazolyl]-2-hydroxypropyl]-methylammonium IUPAC Name: [(2R)-3-(2-benzhydrylbenzimidazol-1-yl)-2-hydroxypropyl]-butyl-methylazanium Traditional Name: [(2R)-3-(2-benzhydrylbenzimidazol-1-yl)-2-hydroxy-propyl]-butyl-methyl-ammonium Formula: C28H34N3O+ MolecularWeight: 428.58906

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC(CN1C2=CC=CC=C2N=C1C(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCCC[NH+](C)C[C@@H](CN1C2=CC=CC=C2N=C1C(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C28H33N3O/c1-3-4-19-30(2)20-24(32)21-31-26-18-12-11-17-25(26)29-28(31)27(22-13-7-5-8-14-22)23-15-9-6-10-16-23/h5-18,24,27,32H,3-4,19-21H2,1-2H3/p+1/t24-/m0/s1