[(1S)-1-[1-(4-phenoxybutyl)benzimidazol-2-yl]butyl]azanium

Systemtic Name: [(1S)-1-[1-(4-phenoxybutyl)benzimidazol-2-yl]butyl]azanium Openeye Name: [(1S)-1-[1-(4-phenoxybutyl)benzimidazol-2-yl]butyl]ammonium CAS Name: [(1S)-1-[1-(4-phenoxybutyl)-2-benzimidazolyl]butyl]ammonium IUPAC Name: [(1S)-1-[1-(4-phenoxybutyl)benzimidazol-2-yl]butyl]azanium Traditional Name: [(1S)-1-[1-(4-phenoxybutyl)benzimidazol-2-yl]butyl]ammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC2=CC=CC=C2N1CCCCOC3=CC=CC=C3)[NH3+]

Isomeric SMILES

CCC[C@@H](C1=NC2=CC=CC=C2N1CCCCOC3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C21H27N3O/c1-2-10-18(22)21-23-19-13-6-7-14-20(19)24(21)15-8-9-16-25-17-11-4-3-5-12-17/h3-7,11-14,18H,2,8-10,15-16,22H2,1H3/p+1/t18-/m0/s1