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

Systemtic Name: 1-[9-(hydroxymethyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone Openeye Name: 1-[9-(hydroxymethyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone CAS Name: 1-[9-(hydroxymethyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone IUPAC Name: 1-[9-(hydroxymethyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]ethanone Traditional Name: 1-(9-methylol-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Formula: C17H16O2S MolecularWeight: 284.37274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SC3=C(CC2)C=CC(=C3)CO

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SC3=C(CC2)C=CC(=C3)CO

InChI

InChI=1S/C17H16O2S/c1-11(19)14-6-7-16-15(9-14)5-4-13-3-2-12(10-18)8-17(13)20-16/h2-3,6-9,18H,4-5,10H2,1H3