3-[1-(cyanomethyl)-5,6-dimethyl-benzimidazol-2-yl]propylazanium

Systemtic Name: 3-[1-(cyanomethyl)-5,6-dimethyl-benzimidazol-2-yl]propylazanium Openeye Name: 3-[1-(cyanomethyl)-5,6-dimethyl-benzimidazol-2-yl]propylammonium CAS Name: 3-[1-(cyanomethyl)-5,6-dimethyl-2-benzimidazolyl]propylammonium IUPAC Name: 3-[1-(cyanomethyl)-5,6-dimethylbenzimidazol-2-yl]propylazanium Traditional Name: 3-[1-(cyanomethyl)-5,6-dimethyl-benzimidazol-2-yl]propylammonium Formula: C14H19N4+ MolecularWeight: 243.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CCC[NH3+])CC#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CCC[NH3+])CC#N

InChI

InChI=1S/C14H18N4/c1-10-8-12-13(9-11(10)2)18(7-6-16)14(17-12)4-3-5-15/h8-9H,3-5,7,15H2,1-2H3/p+1