(2S)-1-[[3-(3-methylbutyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol

Systemtic Name: (2S)-1-[[3-(3-methylbutyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Openeye Name: (2S)-1-[(3-isopentyl-1H-benzimidazol-3-ium-2-yl)amino]propan-2-ol CAS Name: (2S)-1-[[3-(3-methylbutyl)-1H-benzimidazol-3-ium-2-yl]amino]-2-propanol IUPAC Name: (2S)-1-[[3-(3-methylbutyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Traditional Name: (2S)-1-[(3-isoamyl-1H-benzimidazol-3-ium-2-yl)amino]propan-2-ol Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[N+]1=C(NC2=CC=CC=C21)NCC(C)O

Isomeric SMILES

C[C@@H](CNC1=[N+](C2=CC=CC=C2N1)CCC(C)C)O

InChI

InChI=1S/C15H23N3O/c1-11(2)8-9-18-14-7-5-4-6-13(14)17-15(18)16-10-12(3)19/h4-7,11-12,19H,8-10H2,1-3H3,(H,16,17)/p+1/t12-/m0/s1