(2E)-2-(dimethylaminomethylidene)-1-(4-fluorophenyl)-4-morpholin-4-ium-4-yl-butan-1-one

Systemtic Name: (2E)-2-(dimethylaminomethylidene)-1-(4-fluorophenyl)-4-morpholin-4-ium-4-yl-butan-1-one Openeye Name: (2E)-2-(dimethylaminomethylene)-1-(4-fluorophenyl)-4-morpholin-4-ium-4-yl-butan-1-one CAS Name: (2E)-2-(dimethylaminomethylidene)-1-(4-fluorophenyl)-4-(4-morpholin-4-iumyl)-1-butanone IUPAC Name: (2E)-2-(dimethylaminomethylidene)-1-(4-fluorophenyl)-4-morpholin-4-ium-4-ylbutan-1-one Traditional Name: (E)-3-(dimethylamino)-1-(4-fluorophenyl)-2-(2-morpholin-4-ium-4-ylethyl)prop-2-en-1-one Formula: C17H24FN2O2+ MolecularWeight: 307.383063

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(CC[NH+]1CCOCC1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(C)/C=C(\CC[NH+]1CCOCC1)/C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H23FN2O2/c1-19(2)13-15(7-8-20-9-11-22-12-10-20)17(21)14-3-5-16(18)6-4-14/h3-6,13H,7-12H2,1-2H3/p+1/b15-13+