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

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (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 (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (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 (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C18H13ClO6S MolecularWeight: 392.81022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H13ClO6S/c19-16-5-4-15(26-16)13(21)3-6-17(22)24-9-10-7-18(23)25-14-8-11(20)1-2-12(10)14/h1-2,4-5,7-8,20H,3,6,9H2