[2-methyl-4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-methyl-4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-methyl-4-oxo-3-[4-[oxo(propoxy)methyl]phenoxy]-1-benzopyran-7-yl] ester IUPAC Name: [2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-keto-2-methyl-3-(4-propoxycarbonylphenoxy)chromen-7-yl] ester Formula: C28H22O9 MolecularWeight: 502.46888

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C28H22O9/c1-3-12-32-27(30)17-4-7-19(8-5-17)36-26-16(2)35-23-14-20(9-10-21(23)25(26)29)37-28(31)18-6-11-22-24(13-18)34-15-33-22/h4-11,13-14H,3,12,15H2,1-2H3