2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-fluorophenyl)ethanone

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-fluorophenyl)ethanone Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-fluorophenyl)ethanone CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(3-fluorophenyl)ethanone IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(3-fluorophenyl)ethanone Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(3-fluorophenyl)ethanone Formula: C17H15FO3S MolecularWeight: 318.362603

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC(=CC=C3)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC(=CC=C3)F)OC1

InChI

InChI=1S/C17H15FO3S/c18-13-4-1-3-12(9-13)15(19)11-22-14-5-6-16-17(10-14)21-8-2-7-20-16/h1,3-6,9-10H,2,7-8,11H2