4,7-dimethyl-3-(3-methylbut-2-enyl)-2,9-bis(oxidanyl)-6-oxidanylidene-benzo[b][1,4]benzodioxepine-10-carbaldehyde

Systemtic Name: 4,7-dimethyl-3-(3-methylbut-2-enyl)-2,9-bis(oxidanyl)-6-oxidanylidene-benzo[b][1,4]benzodioxepine-10-carbaldehyde Openeye Name: 2,9-dihydroxy-4,7-dimethyl-3-(3-methylbut-2-enyl)-6-oxo-benzo[b][1,4]benzodioxepine-10-carbaldehyde CAS Name: 2,9-dihydroxy-4,7-dimethyl-3-(3-methylbut-2-enyl)-6-oxo-10-benzo[b][1,4]benzodioxepincarboxaldehyde IUPAC Name: 2,9-dihydroxy-4,7-dimethyl-3-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde Traditional Name: 2,9-dihydroxy-6-keto-4,7-dimethyl-3-(3-methylbut-2-enyl)benzo[b][1,4]benzodioxepin-10-carbaldehyde Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)OC3=C(C(=C(C=C3O2)O)CC=C(C)C)C)C=O)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)OC3=C(C(=C(C=C3O2)O)CC=C(C)C)C)C=O)O

InChI

InChI=1S/C21H20O6/c1-10(2)5-6-13-12(4)19-17(8-16(13)24)26-20-14(9-22)15(23)7-11(3)18(20)21(25)27-19/h5,7-9,23-24H,6H2,1-4H3