1-(2-fluoranyl-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)propan-2-one

Systemtic Name: 1-(2-fluoranyl-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)propan-2-one Openeye Name: 1-(2-fluoro-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)propan-2-one CAS Name: 1-(2-fluoro-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)-2-propanone IUPAC Name: 1-(2-fluoro-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)propan-2-one Traditional Name: 1-(2-fluoro-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-5-ium-5-yl)acetone Formula: C15H18FN2O+ MolecularWeight: 261.314623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[N+]1=C2CCCCCN2C3=C1C=CC(=C3)F

Isomeric SMILES

CC(=O)C[N+]1=C2CCCCCN2C3=C1C=CC(=C3)F

InChI

InChI=1S/C15H18FN2O/c1-11(19)10-18-13-7-6-12(16)9-14(13)17-8-4-2-3-5-15(17)18/h6-7,9H,2-5,8,10H2,1H3/q+1