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

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 1,3-benzodioxole-5-carboxylate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C21H17NO8 MolecularWeight: 411.36158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H17NO8/c1-2-26-21(25)22-14-4-5-15-13(8-19(23)30-17(15)9-14)10-27-20(24)12-3-6-16-18(7-12)29-11-28-16/h3-9H,2,10-11H2,1H3,(H,22,25)