[(1S)-1-[1-(cyanomethyl)-5,6-dimethoxy-benzimidazol-2-yl]butyl]azanium

Systemtic Name: [(1S)-1-[1-(cyanomethyl)-5,6-dimethoxy-benzimidazol-2-yl]butyl]azanium Openeye Name: [(1S)-1-[1-(cyanomethyl)-5,6-dimethoxy-benzimidazol-2-yl]butyl]ammonium CAS Name: [(1S)-1-[1-(cyanomethyl)-5,6-dimethoxy-2-benzimidazolyl]butyl]ammonium IUPAC Name: [(1S)-1-[1-(cyanomethyl)-5,6-dimethoxybenzimidazol-2-yl]butyl]azanium Traditional Name: [(1S)-1-[1-(cyanomethyl)-5,6-dimethoxy-benzimidazol-2-yl]butyl]ammonium Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC2=CC(=C(C=C2N1CC#N)OC)OC)[NH3+]

Isomeric SMILES

CCC[C@@H](C1=NC2=CC(=C(C=C2N1CC#N)OC)OC)[NH3+]

InChI

InChI=1S/C15H20N4O2/c1-4-5-10(17)15-18-11-8-13(20-2)14(21-3)9-12(11)19(15)7-6-16/h8-10H,4-5,7,17H2,1-3H3/p+1/t10-/m0/s1