[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(3-chloranyl-2-fluoranyl-phenyl)azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(3-chloranyl-2-fluoranyl-phenyl)azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-(3-chloro-2-fluoro-phenyl)ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-(3-chloro-2-fluorophenyl)ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-(3-chloro-2-fluorophenyl)azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-(3-chloro-2-fluoro-phenyl)ammonium Formula: C14H19ClFN2O+ MolecularWeight: 285.764863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH2+]C2=C(C(=CC=C2)Cl)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH2+]C2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C14H18ClFN2O/c15-11-6-5-7-12(14(11)16)17-10-13(19)18-8-3-1-2-4-9-18/h5-7,17H,1-4,8-10H2/p+1