[(1S)-1-[1-(3-methylbutyl)benzimidazol-2-yl]butyl]azanium

Systemtic Name: [(1S)-1-[1-(3-methylbutyl)benzimidazol-2-yl]butyl]azanium Openeye Name: [(1S)-1-(1-isopentylbenzimidazol-2-yl)butyl]ammonium CAS Name: [(1S)-1-[1-(3-methylbutyl)-2-benzimidazolyl]butyl]ammonium IUPAC Name: [(1S)-1-[1-(3-methylbutyl)benzimidazol-2-yl]butyl]azanium Traditional Name: [(1S)-1-(1-isoamylbenzimidazol-2-yl)butyl]ammonium Formula: C16H26N3+ MolecularWeight: 260.39774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC2=CC=CC=C2N1CCC(C)C)[NH3+]

Isomeric SMILES

CCC[C@@H](C1=NC2=CC=CC=C2N1CCC(C)C)[NH3+]

InChI

InChI=1S/C16H25N3/c1-4-7-13(17)16-18-14-8-5-6-9-15(14)19(16)11-10-12(2)3/h5-6,8-9,12-13H,4,7,10-11,17H2,1-3H3/p+1/t13-/m0/s1