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

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(2,5-dimethoxyphenyl)ethanone Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(2,5-dimethoxyphenyl)ethanone CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(2,5-dimethoxyphenyl)ethanone IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(2,5-dimethoxyphenyl)ethanone Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-(2,5-dimethoxyphenyl)ethanone Formula: C19H20O5S MolecularWeight: 360.4241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H20O5S/c1-21-13-4-6-17(22-2)15(10-13)16(20)12-25-14-5-7-18-19(11-14)24-9-3-8-23-18/h4-7,10-11H,3,8-9,12H2,1-2H3