6-ethyl-9-(4-hydroxyphenyl)-2,3-bis(oxidanyl)-6H-benzo[b][1]benzothiepin-5-one

Systemtic Name: 6-ethyl-9-(4-hydroxyphenyl)-2,3-bis(oxidanyl)-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 6-ethyl-2,3-dihydroxy-9-(4-hydroxyphenyl)-6H-benzo[b][1]benzothiepin-5-one CAS Name: 6-ethyl-2,3-dihydroxy-9-(4-hydroxyphenyl)-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 6-ethyl-2,3-dihydroxy-9-(4-hydroxyphenyl)-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 6-ethyl-2,3-dihydroxy-9-(4-hydroxyphenyl)-6H-benzo[b][1]benzothiepin-5-one Formula: C22H18O4S MolecularWeight: 378.44092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(C=C(C=C2)C3=CC=C(C=C3)O)SC4=CC(=C(C=C4C1=O)O)O

Isomeric SMILES

CCC1C2=C(C=C(C=C2)C3=CC=C(C=C3)O)SC4=CC(=C(C=C4C1=O)O)O

InChI

InChI=1S/C22H18O4S/c1-2-15-16-8-5-13(12-3-6-14(23)7-4-12)9-20(16)27-21-11-19(25)18(24)10-17(21)22(15)26/h3-11,15,23-25H,2H2,1H3