2,4-bis(oxidanyl)-9-thiophen-2-yl-6H-benzo[b][1]benzoxepin-5-one

Systemtic Name: 2,4-bis(oxidanyl)-9-thiophen-2-yl-6H-benzo[b][1]benzoxepin-5-one Openeye Name: 2,4-dihydroxy-9-(2-thienyl)-6H-benzo[b][1]benzoxepin-5-one CAS Name: 2,4-dihydroxy-9-thiophen-2-yl-6H-benzo[b][1]benzoxepin-5-one IUPAC Name: 2,4-dihydroxy-9-thiophen-2-yl-6H-benzo[b][1]benzoxepin-5-one Traditional Name: 2,4-dihydroxy-9-(2-thienyl)-6H-benzo[b][1]benzoxepin-5-one Formula: C18H12O4S MolecularWeight: 324.35048

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C3=CC=CS3)OC4=CC(=CC(=C4C1=O)O)O

Isomeric SMILES

C1C2=C(C=C(C=C2)C3=CC=CS3)OC4=CC(=CC(=C4C1=O)O)O

InChI

InChI=1S/C18H12O4S/c19-12-8-14(21)18-13(20)6-10-3-4-11(17-2-1-5-23-17)7-15(10)22-16(18)9-12/h1-5,7-9,19,21H,6H2