[5-acetyloxy-3-(1,3-benzodioxol-5-yl)-8-(3-methylbut-2-enyl)-4-oxidanylidene-chromen-7-yl] ethanoate

Systemtic Name: [5-acetyloxy-3-(1,3-benzodioxol-5-yl)-8-(3-methylbut-2-enyl)-4-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [5-acetoxy-3-(1,3-benzodioxol-5-yl)-8-(3-methylbut-2-enyl)-4-oxo-chromen-7-yl] acetate CAS Name: acetic acid [5-acetyloxy-3-(1,3-benzodioxol-5-yl)-8-(3-methylbut-2-enyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [5-acetyloxy-3-(1,3-benzodioxol-5-yl)-8-(3-methylbut-2-enyl)-4-oxochromen-7-yl] acetate Traditional Name: acetic acid [5-acetoxy-3-(1,3-benzodioxol-5-yl)-4-keto-8-(3-methylbut-2-enyl)chromen-7-yl] ester Formula: C25H22O8 MolecularWeight: 450.43738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C2=C1OC=C(C2=O)C3=CC4=C(C=C3)OCO4)OC(=O)C)OC(=O)C)C

Isomeric SMILES

CC(=CCC1=C(C=C(C2=C1OC=C(C2=O)C3=CC4=C(C=C3)OCO4)OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C25H22O8/c1-13(2)5-7-17-20(32-14(3)26)10-22(33-15(4)27)23-24(28)18(11-29-25(17)23)16-6-8-19-21(9-16)31-12-30-19/h5-6,8-11H,7,12H2,1-4H3