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

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanone Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-indan-5-yl-ethanone CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(2,3-dihydro-1H-inden-5-yl)ethanone IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanone Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-indan-5-yl-ethanone Formula: C20H20O3S MolecularWeight: 340.436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H20O3S/c21-18(16-6-5-14-3-1-4-15(14)11-16)13-24-17-7-8-19-20(12-17)23-10-2-9-22-19/h5-8,11-12H,1-4,9-10,13H2