methyl 9-methoxy-1,7,10-trimethyl-3-oxidanyl-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylate

Systemtic Name: methyl 9-methoxy-1,7,10-trimethyl-3-oxidanyl-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylate Openeye Name: methyl 3-hydroxy-9-methoxy-1,7,10-trimethyl-6-oxo-benzo[b][1,4]benzodioxepine-2-carboxylate CAS Name: 3-hydroxy-9-methoxy-1,7,10-trimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester IUPAC Name: methyl 3-hydroxy-9-methoxy-1,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylate Traditional Name: 3-hydroxy-6-keto-9-methoxy-1,7,10-trimethyl-benzo[b][1,4]benzodioxepin-2-carboxylic acid methyl ester Formula: C19H18O7 MolecularWeight: 358.34202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18O7/c1-8-6-12(23-4)9(2)17-14(8)19(22)25-13-7-11(20)15(18(21)24-5)10(3)16(13)26-17/h6-7,20H,1-5H3