ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethoxy]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethoxy]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethoxy]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethoxy]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethoxy]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H19NO7/c1-3-25-21(24)20-12(2)29-16-7-5-14(9-15(16)20)26-10-19(23)22-13-4-6-17-18(8-13)28-11-27-17/h4-9H,3,10-11H2,1-2H3,(H,22,23)