[(1S)-1-(3-chloranyl-4-fluoranyl-phenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(3-chloranyl-4-fluoranyl-phenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1S)-1-(3-chloro-4-fluorophenyl)ethyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1S)-1-(3-chloro-4-fluorophenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C14H18ClFN3+ MolecularWeight: 282.764223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Cl)[NH2+]CCCN2C=CN=C2

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)F)Cl)[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C14H17ClFN3/c1-11(12-3-4-14(16)13(15)9-12)18-5-2-7-19-8-6-17-10-19/h3-4,6,8-11,18H,2,5,7H2,1H3/p+1/t11-/m0/s1