1-[7,9-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone

Systemtic Name: 1-[7,9-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone Openeye Name: 1-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone CAS Name: 1-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone IUPAC Name: 1-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Traditional Name: 1-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SC3=CC(=CC(=C3CC2)O)O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SC3=CC(=CC(=C3CC2)O)O

InChI

InChI=1S/C16H14O3S/c1-9(17)10-3-5-15-11(6-10)2-4-13-14(19)7-12(18)8-16(13)20-15/h3,5-8,18-19H,2,4H2,1H3