2-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxy-benzimidazol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxy-benzimidazol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxy-benzimidazol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[2-[(1S)-1-ammoniopropyl]-5,6-dimethoxy-1-benzimidazolyl]ethyl-dimethylammonium IUPAC Name: 2-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxybenzimidazol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[2-[(1S)-1-ammoniopropyl]-5,6-dimethoxy-benzimidazol-1-yl]ethyl-dimethyl-ammonium Formula: C16H28N4O2+2 MolecularWeight: 308.41912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC(=C(C=C2N1CC[NH+](C)C)OC)OC)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=CC(=C(C=C2N1CC[NH+](C)C)OC)OC)[NH3+]

InChI

InChI=1S/C16H26N4O2/c1-6-11(17)16-18-12-9-14(21-4)15(22-5)10-13(12)20(16)8-7-19(2)3/h9-11H,6-8,17H2,1-5H3/p+2/t11-/m0/s1