(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-oxidanylidenechromene-3-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C21H14ClNO4S MolecularWeight: 411.85816

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=CC=CC=C4OC3=O)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=CC=CC=C4OC3=O)Cl

InChI

InChI=1S/C21H14ClNO4S/c1-28-15-7-6-12-8-14(19(22)23-17(12)10-15)11-26-20(24)16-9-13-4-2-3-5-18(13)27-21(16)25/h2-10H,11H2,1H3