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

Systemtic Name: [7,9-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]-cyclobutyl-methanone Openeye Name: cyclobutyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone CAS Name: cyclobutyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone IUPAC Name: cyclobutyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone Traditional Name: cyclobutyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)C2=CC3=C(C=C2)SC4=CC(=CC(=C4CC3)O)O

Isomeric SMILES

C1CC(C1)C(=O)C2=CC3=C(C=C2)SC4=CC(=CC(=C4CC3)O)O

InChI

InChI=1S/C19H18O3S/c20-14-9-16(21)15-6-4-12-8-13(19(22)11-2-1-3-11)5-7-17(12)23-18(15)10-14/h5,7-11,20-21H,1-4,6H2