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

Systemtic Name: dimethyl 3-methyl-5-[2-(4-oxidanylidenechromen-2-yl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(4-oxochromene-2-carbonyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[oxo-(4-oxo-1-benzopyran-2-yl)methoxy]ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(4-oxochromene-2-carbonyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-ketochromene-2-carbonyl)oxyacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H17NO9S MolecularWeight: 459.42598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC(=O)C3=CC=CC=C3O2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC(=O)C3=CC=CC=C3O2)C(=O)OC

InChI

InChI=1S/C21H17NO9S/c1-10-16(20(26)28-2)18(32-17(10)21(27)29-3)22-15(24)9-30-19(25)14-8-12(23)11-6-4-5-7-13(11)31-14/h4-8H,9H2,1-3H3,(H,22,24)