6,6-dimethyl-2,3-bis(oxidanyl)benzo[b][1]benzothiepin-5-one

Systemtic Name: 6,6-dimethyl-2,3-bis(oxidanyl)benzo[b][1]benzothiepin-5-one Openeye Name: 2,3-dihydroxy-6,6-dimethyl-benzo[b][1]benzothiepin-5-one CAS Name: 2,3-dihydroxy-6,6-dimethyl-5-benzo[b][1]benzothiepinone IUPAC Name: 2,3-dihydroxy-6,6-dimethylbenzo[b][1]benzothiepin-5-one Traditional Name: 2,3-dihydroxy-6,6-dimethyl-benzo[b][1]benzothiepin-5-one Formula: C16H14O3S MolecularWeight: 286.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2SC3=CC(=C(C=C3C1=O)O)O)C

Isomeric SMILES

CC1(C2=CC=CC=C2SC3=CC(=C(C=C3C1=O)O)O)C

InChI

InChI=1S/C16H14O3S/c1-16(2)10-5-3-4-6-13(10)20-14-8-12(18)11(17)7-9(14)15(16)19/h3-8,17-18H,1-2H3