[(1S)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-6-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-6-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-6-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(5,6-dimethyl-1-benzimidazolyl)-6-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-6-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-6-fluoro-phenyl]ethyl]ammonium Formula: C17H19FN3+ MolecularWeight: 284.351263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18FN3/c1-10-7-14-16(8-11(10)2)21(9-20-14)15-6-4-5-13(18)17(15)12(3)19/h4-9,12H,19H2,1-3H3/p+1/t12-/m0/s1