7,8-dimethoxy-3,3-dimethyl-5-(1-oxidanidylpyridin-1-ium-2-yl)-2,4-dihydro-1-benzoxepin-5-ol

Systemtic Name: 7,8-dimethoxy-3,3-dimethyl-5-(1-oxidanidylpyridin-1-ium-2-yl)-2,4-dihydro-1-benzoxepin-5-ol Openeye Name: 7,8-dimethoxy-3,3-dimethyl-5-(1-oxidopyridin-1-ium-2-yl)-2,4-dihydro-1-benzoxepin-5-ol CAS Name: 7,8-dimethoxy-3,3-dimethyl-5-(1-oxido-2-pyridin-1-iumyl)-2,4-dihydro-1-benzoxepin-5-ol IUPAC Name: 7,8-dimethoxy-3,3-dimethyl-5-(1-oxidopyridin-1-ium-2-yl)-2,4-dihydro-1-benzoxepin-5-ol Traditional Name: 7,8-dimethoxy-3,3-dimethyl-5-(1-oxidopyridin-1-ium-2-yl)-2,4-dihydro-1-benzoxepin-5-ol Formula: C19H23NO5 MolecularWeight: 345.38962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CC(=C(C=C2OC1)OC)OC)(C3=CC=CC=[N+]3[O-])O)C

Isomeric SMILES

CC1(CC(C2=CC(=C(C=C2OC1)OC)OC)(C3=CC=CC=[N+]3[O-])O)C

InChI

InChI=1S/C19H23NO5/c1-18(2)11-19(21,17-7-5-6-8-20(17)22)13-9-15(23-3)16(24-4)10-14(13)25-12-18/h5-10,21H,11-12H2,1-4H3