2-(2-methylbenzimidazol-1-yl)ethyl-[(2S)-4-methylpentan-2-yl]azanium

Systemtic Name: 2-(2-methylbenzimidazol-1-yl)ethyl-[(2S)-4-methylpentan-2-yl]azanium Openeye Name: [(1S)-1,3-dimethylbutyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]ammonium CAS Name: 2-(2-methyl-1-benzimidazolyl)ethyl-[(2S)-4-methylpentan-2-yl]ammonium IUPAC Name: 2-(2-methylbenzimidazol-1-yl)ethyl-[(2S)-4-methylpentan-2-yl]azanium Traditional Name: [(1S)-1,3-dimethylbutyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]ammonium Formula: C16H26N3+ MolecularWeight: 260.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC[NH2+]C(C)CC(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC[NH2+][C@@H](C)CC(C)C

InChI

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