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

Systemtic Name: [7,9-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]-cyclopropyl-methanone Openeye Name: cyclopropyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone CAS Name: cyclopropyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone IUPAC Name: cyclopropyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone Traditional Name: cyclopropyl-(7,9-dihydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)methanone Formula: C18H16O3S MolecularWeight: 312.38284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C2=CC3=C(C=C2)SC4=CC(=CC(=C4CC3)O)O

Isomeric SMILES

C1CC1C(=O)C2=CC3=C(C=C2)SC4=CC(=CC(=C4CC3)O)O

InChI

InChI=1S/C18H16O3S/c19-13-8-15(20)14-5-3-11-7-12(18(21)10-1-2-10)4-6-16(11)22-17(14)9-13/h4,6-10,19-20H,1-3,5H2