[(1S)-1-(1-methanoyl-7-methoxy-3-methyl-6-oxidanylidene-benzo[b][1,4]benzodioxepin-8-yl)-3-methyl-butyl] ethanoate

Systemtic Name: [(1S)-1-(1-methanoyl-7-methoxy-3-methyl-6-oxidanylidene-benzo[b][1,4]benzodioxepin-8-yl)-3-methyl-butyl] ethanoate Openeye Name: [(1S)-1-(1-formyl-7-methoxy-3-methyl-6-oxo-benzo[b][1,4]benzodioxepin-8-yl)-3-methyl-butyl] acetate CAS Name: acetic acid [(1S)-1-(1-formyl-7-methoxy-3-methyl-6-oxo-8-benzo[b][1,4]benzodioxepinyl)-3-methylbutyl] ester IUPAC Name: [(1S)-1-(1-formyl-7-methoxy-3-methyl-6-oxobenzo[b][1,4]benzodioxepin-8-yl)-3-methylbutyl] acetate Traditional Name: acetic acid [(1S)-1-(1-formyl-6-keto-7-methoxy-3-methyl-benzo[b][1,4]benzodioxepin-8-yl)-3-methyl-butyl] ester Formula: C23H24O7 MolecularWeight: 412.43246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C=O)OC3=C(C(=C(C=C3)C(CC(C)C)OC(=O)C)OC)C(=O)O2

Isomeric SMILES

CC1=CC2=C(C(=C1)C=O)OC3=C(C(=C(C=C3)[C@H](CC(C)C)OC(=O)C)OC)C(=O)O2

InChI

InChI=1S/C23H24O7/c1-12(2)8-18(28-14(4)25)16-6-7-17-20(22(16)27-5)23(26)30-19-10-13(3)9-15(11-24)21(19)29-17/h6-7,9-12,18H,8H2,1-5H3/t18-/m0/s1