bis(2-methylpropyl)-[(2R)-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: bis(2-methylpropyl)-[(2R)-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-2-hydroxy-3-[2-(1-naphthylmethyl)benzimidazol-1-yl]propyl]-diisobutyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-(1-naphthalenylmethyl)-1-benzimidazolyl]propyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(2R)-2-hydroxy-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]propyl]-bis(2-methylpropyl)azanium Traditional Name: [(2R)-2-hydroxy-3-[2-(1-naphthylmethyl)benzimidazol-1-yl]propyl]-diisobutyl-ammonium Formula: C29H38N3O+ MolecularWeight: 444.63152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)CC(CN1C2=CC=CC=C2N=C1CC3=CC=CC4=CC=CC=C43)O

Isomeric SMILES

CC(C)C[NH+](C[C@@H](CN1C2=CC=CC=C2N=C1CC3=CC=CC4=CC=CC=C43)O)CC(C)C

InChI

InChI=1S/C29H37N3O/c1-21(2)17-31(18-22(3)4)19-25(33)20-32-28-15-8-7-14-27(28)30-29(32)16-24-12-9-11-23-10-5-6-13-26(23)24/h5-15,21-22,25,33H,16-20H2,1-4H3/p+1/t25-/m0/s1