methyl 4-aminocarbonyl-5-(1,3-benzodioxol-5-ylcarbonylamino)-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 4-aminocarbonyl-5-(1,3-benzodioxol-5-ylcarbonylamino)-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-(1,3-benzodioxole-5-carbonylamino)-4-carbamoyl-2-methyl-furan-3-carboxylate CAS Name: 5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-carbamoyl-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzodioxole-5-carbonylamino)-4-carbamoyl-2-methylfuran-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-(piperonyloylamino)furan-3-carboxylic acid methyl ester Formula: C16H14N2O7 MolecularWeight: 346.29156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(O1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N)C(=O)OC

InChI

InChI=1S/C16H14N2O7/c1-7-11(16(21)22-2)12(13(17)19)15(25-7)18-14(20)8-3-4-9-10(5-8)24-6-23-9/h3-5H,6H2,1-2H3,(H2,17,19)(H,18,20)