diethyl 3-methyl-5-[(4-oxidanylidenechromen-3-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(4-oxidanylidenechromen-3-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(4-oxochromene-3-carbonyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-(4-oxo-1-benzopyran-3-yl)methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(4-oxochromene-3-carbonyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[(4-ketochromene-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H19NO7S MolecularWeight: 429.44306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=COC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=COC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H19NO7S/c1-4-27-20(25)15-11(3)17(21(26)28-5-2)30-19(15)22-18(24)13-10-29-14-9-7-6-8-12(14)16(13)23/h6-10H,4-5H2,1-3H3,(H,22,24)