1-[3-methylidene-5-(phenylsulfonyl)-4,5-dihydro-1-benzoxepin-7-yl]ethanone

Systemtic Name: 1-[3-methylidene-5-(phenylsulfonyl)-4,5-dihydro-1-benzoxepin-7-yl]ethanone Openeye Name: 1-[5-(benzenesulfonyl)-3-methylene-4,5-dihydro-1-benzoxepin-7-yl]ethanone CAS Name: 1-[5-(benzenesulfonyl)-3-methylene-4,5-dihydro-1-benzoxepin-7-yl]ethanone IUPAC Name: 1-[5-(benzenesulfonyl)-3-methylidene-4,5-dihydro-1-benzoxepin-7-yl]ethanone Traditional Name: 1-(5-besyl-3-methylene-4,5-dihydro-1-benzoxepin-7-yl)ethanone Formula: C19H18O4S MolecularWeight: 342.40882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=C)CC2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=C)CC2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18O4S/c1-13-10-19(24(21,22)16-6-4-3-5-7-16)17-11-15(14(2)20)8-9-18(17)23-12-13/h3-9,11,19H,1,10,12H2,2H3