8-methyl-3-methylsulfanyl-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one

Systemtic Name: 8-methyl-3-methylsulfanyl-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one Openeye Name: 8-methyl-3-methylsulfanyl-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one CAS Name: 8-methyl-3-(methylthio)-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one IUPAC Name: 8-methyl-3-methylsulfanyl-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one Traditional Name: 8-methyl-3-(methylthio)-6a,10a-dihydro-6H-benzo[b][1]benzoxepin-5-one Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2CC(=O)C3=C(C=CC(=C3)SC)OC2C=C1

Isomeric SMILES

CC1=CC2CC(=O)C3=C(C=CC(=C3)SC)OC2C=C1

InChI

InChI=1S/C16H16O2S/c1-10-3-5-15-11(7-10)8-14(17)13-9-12(19-2)4-6-16(13)18-15/h3-7,9,11,15H,8H2,1-2H3