1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydro-[1]benzofuro[3,2-c]pyridin-2-ium-2-yl)butan-1-one chloride

Systemtic Name: 1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydro-[1]benzofuro[3,2-c]pyridin-2-ium-2-yl)butan-1-one chloride Openeye Name: 1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridin-2-ium-2-yl)butan-1-one chloride CAS Name: 1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridin-2-ium-2-yl)-1-butanone chloride IUPAC Name: 1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydro-[1]benzofuro[3,2-c]pyridin-2-ium-2-yl)butan-1-one chloride Traditional Name: 1-(4-fluorophenyl)-4-(1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridin-2-ium-2-yl)butan-1-one chloride Formula: C21H21ClFNO2 MolecularWeight: 373.848343

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1OC3=CC=CC=C23)CCCC(=O)C4=CC=C(C=C4)F.[Cl-]

Isomeric SMILES

C1C[NH+](CC2=C1OC3=CC=CC=C23)CCCC(=O)C4=CC=C(C=C4)F.[Cl-]

InChI

InChI=1S/C21H20FNO2.ClH/c22-16-9-7-15(8-10-16)19(24)5-3-12-23-13-11-21-18(14-23)17-4-1-2-6-20(17)25-21;/h1-2,4,6-10H,3,5,11-14H2;1H