(3S,5R)-5-ethenyl-2,2,8-trimethyl-4,5-dihydro-3H-1-benzoxepine-3,7-diol

Systemtic Name: (3S,5R)-5-ethenyl-2,2,8-trimethyl-4,5-dihydro-3H-1-benzoxepine-3,7-diol Openeye Name: (3S,5R)-2,2,8-trimethyl-5-vinyl-4,5-dihydro-3H-1-benzoxepine-3,7-diol CAS Name: (3S,5R)-5-ethenyl-2,2,8-trimethyl-4,5-dihydro-3H-1-benzoxepin-3,7-diol IUPAC Name: (3S,5R)-5-ethenyl-2,2,8-trimethyl-4,5-dihydro-3H-1-benzoxepine-3,7-diol Traditional Name: (3S,5R)-2,2,8-trimethyl-5-vinyl-4,5-dihydro-3H-1-benzoxepin-3,7-diol Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(CC(C(OC2=C1)(C)C)O)C=C)O

Isomeric SMILES

CC1=C(C=C2[C@H](C[C@@H](C(OC2=C1)(C)C)O)C=C)O

InChI

InChI=1S/C15H20O3/c1-5-10-7-14(17)15(3,4)18-13-6-9(2)12(16)8-11(10)13/h5-6,8,10,14,16-17H,1,7H2,2-4H3/t10-,14-/m0/s1