2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepine-7-thiol

Systemtic Name: 2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepine-7-thiol Openeye Name: 2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepine-7-thiol CAS Name: 2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepin-7-thiol IUPAC Name: 2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepine-7-thiol Traditional Name: 2,2,6,8-tetramethyl-4,5-dihydro-3H-1-benzoxepin-7-thiol Formula: C14H20OS MolecularWeight: 236.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CCCC(O2)(C)C)C(=C1S)C

Isomeric SMILES

CC1=CC2=C(CCCC(O2)(C)C)C(=C1S)C

InChI

InChI=1S/C14H20OS/c1-9-8-12-11(10(2)13(9)16)6-5-7-14(3,4)15-12/h8,16H,5-7H2,1-4H3