(6-chloranyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: (6-chloranyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (6-chloro-7-hydroxy-2-oxo-chromen-4-yl)methyl 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid (6-chloro-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-hydroxy-2-oxochromen-4-yl)methyl 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid (6-chloro-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C18H12Cl2O6S MolecularWeight: 427.25528

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)C(=O)CCC(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

Isomeric SMILES

C1=C(SC(=C1)Cl)C(=O)CCC(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

InChI

InChI=1S/C18H12Cl2O6S/c19-11-6-10-9(5-18(24)26-14(10)7-13(11)22)8-25-17(23)4-1-12(21)15-2-3-16(20)27-15/h2-3,5-7,22H,1,4,8H2