dimethyl 5-[2-(5-bromanylfuran-2-yl)carbonyloxyethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[2-(5-bromanylfuran-2-yl)carbonyloxyethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[2-(5-bromofuran-2-carbonyl)oxyacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[(5-bromo-2-furanyl)-oxomethoxy]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(5-bromofuran-2-carbonyl)oxyacetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(5-bromo-2-furoyl)oxyacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H14BrNO8S MolecularWeight: 460.25326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC=C(O2)Br)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC=C(O2)Br)C(=O)OC

InChI

InChI=1S/C16H14BrNO8S/c1-7-11(15(21)23-2)13(27-12(7)16(22)24-3)18-10(19)6-25-14(20)8-4-5-9(17)26-8/h4-5H,6H2,1-3H3,(H,18,19)