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

Systemtic Name: [3-(4-ethoxycarbonylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [3-(4-ethoxycarbonylphenoxy)-2-methyl-4-oxo-chromen-7-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-(4-ethoxycarbonylphenoxy)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-ethoxycarbonylphenoxy)-2-methyl-4-oxochromen-7-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-(4-carbethoxyphenoxy)-4-keto-2-methyl-chromen-7-yl] ester Formula: C27H20O9 MolecularWeight: 488.4423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=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

CCOC(=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/C27H20O9/c1-3-31-26(29)16-4-7-18(8-5-16)35-25-15(2)34-22-13-19(9-10-20(22)24(25)28)36-27(30)17-6-11-21-23(12-17)33-14-32-21/h4-13H,3,14H2,1-2H3