methyl 2-[(4-chlorophenyl)amino]-4-methyl-5-(2-oxidanylidenechromen-3-yl)carbonyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-chlorophenyl)amino]-4-methyl-5-(2-oxidanylidenechromen-3-yl)carbonyl-thiophene-3-carboxylate Openeye Name: methyl 2-(4-chloroanilino)-4-methyl-5-(2-oxochromene-3-carbonyl)thiophene-3-carboxylate CAS Name: 2-(4-chloroanilino)-4-methyl-5-[oxo-(2-oxo-1-benzopyran-3-yl)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-chloroanilino)-4-methyl-5-(2-oxochromene-3-carbonyl)thiophene-3-carboxylate Traditional Name: 2-(4-chloroanilino)-5-(2-ketochromene-3-carbonyl)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C23H16ClNO5S MolecularWeight: 453.89484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC2=CC=C(C=C2)Cl)C(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC2=CC=C(C=C2)Cl)C(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H16ClNO5S/c1-12-18(23(28)29-2)21(25-15-9-7-14(24)8-10-15)31-20(12)19(26)16-11-13-5-3-4-6-17(13)30-22(16)27/h3-11,25H,1-2H3