[3-[(5,6-dimethylbenzimidazol-1-yl)methyl]-4-fluoranyl-phenyl]methylazanium

Systemtic Name: [3-[(5,6-dimethylbenzimidazol-1-yl)methyl]-4-fluoranyl-phenyl]methylazanium Openeye Name: [3-[(5,6-dimethylbenzimidazol-1-yl)methyl]-4-fluoro-phenyl]methylammonium CAS Name: [3-[(5,6-dimethyl-1-benzimidazolyl)methyl]-4-fluorophenyl]methylammonium IUPAC Name: [3-[(5,6-dimethylbenzimidazol-1-yl)methyl]-4-fluorophenyl]methylazanium Traditional Name: [3-[(5,6-dimethylbenzimidazol-1-yl)methyl]-4-fluoro-benzyl]ammonium Formula: C17H19FN3+ MolecularWeight: 284.351263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CC3=C(C=CC(=C3)C[NH3+])F

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CC3=C(C=CC(=C3)C[NH3+])F

InChI

InChI=1S/C17H18FN3/c1-11-5-16-17(6-12(11)2)21(10-20-16)9-14-7-13(8-19)3-4-15(14)18/h3-7,10H,8-9,19H2,1-2H3/p+1