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

Systemtic Name: 6-ethyl-9-(2-methylphenyl)-2,3-bis(oxidanyl)-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 6-ethyl-2,3-dihydroxy-9-(o-tolyl)-6H-benzo[b][1]benzothiepin-5-one CAS Name: 6-ethyl-2,3-dihydroxy-9-(2-methylphenyl)-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 6-ethyl-2,3-dihydroxy-9-(2-methylphenyl)-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 6-ethyl-2,3-dihydroxy-9-(o-tolyl)-6H-benzo[b][1]benzothiepin-5-one Formula: C23H20O3S MolecularWeight: 376.4681

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(C=C(C=C2)C3=CC=CC=C3C)SC4=CC(=C(C=C4C1=O)O)O

Isomeric SMILES

CCC1C2=C(C=C(C=C2)C3=CC=CC=C3C)SC4=CC(=C(C=C4C1=O)O)O

InChI

InChI=1S/C23H20O3S/c1-3-15-17-9-8-14(16-7-5-4-6-13(16)2)10-21(17)27-22-12-20(25)19(24)11-18(22)23(15)26/h4-12,15,24-25H,3H2,1-2H3