9-methoxy-3-methylsulfanyl-7-oxidanyl-5H-benzo[b][1]benzoxepin-6-one

Systemtic Name: 9-methoxy-3-methylsulfanyl-7-oxidanyl-5H-benzo[b][1]benzoxepin-6-one Openeye Name: 7-hydroxy-9-methoxy-3-methylsulfanyl-5H-benzo[b][1]benzoxepin-6-one CAS Name: 7-hydroxy-9-methoxy-3-(methylthio)-5H-benzo[b][1]benzoxepin-6-one IUPAC Name: 7-hydroxy-9-methoxy-3-methylsulfanyl-5H-benzo[b][1]benzoxepin-6-one Traditional Name: 7-hydroxy-9-methoxy-3-(methylthio)-5H-benzo[b][1]benzoxepin-6-one Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=O)CC3=C(C=CC(=C3)SC)OC2=C1)O

Isomeric SMILES

COC1=CC(=C2C(=O)CC3=C(C=CC(=C3)SC)OC2=C1)O

InChI

InChI=1S/C16H14O4S/c1-19-10-7-13(18)16-12(17)6-9-5-11(21-2)3-4-14(9)20-15(16)8-10/h3-5,7-8,18H,6H2,1-2H3