methyl 5-[[1,3-benzodioxol-5-ylcarbonyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[1,3-benzodioxol-5-ylcarbonyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[1,3-benzodioxole-5-carbonyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[1,3-benzodioxol-5-yl(oxo)methyl]-methylamino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[1,3-benzodioxole-5-carbonyl(methyl)amino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 2-methyl-5-[[methyl(piperonyloyl)amino]methyl]furan-3-carboxylic acid methyl ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

InChI

InChI=1S/C17H17NO6/c1-10-13(17(20)21-3)7-12(24-10)8-18(2)16(19)11-4-5-14-15(6-11)23-9-22-14/h4-7H,8-9H2,1-3H3