2-(2-chloranyl-6-fluoranyl-phenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone CAS Name: 2-(2-chloro-6-fluorophenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone IUPAC Name: 2-(2-chloro-6-fluorophenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Formula: C14H19ClFN2O+ MolecularWeight: 285.764863

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H18ClFN2O/c1-17-6-3-7-18(9-8-17)14(19)10-11-12(15)4-2-5-13(11)16/h2,4-5H,3,6-10H2,1H3/p+1