(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C17H14Cl2O5S MolecularWeight: 401.26106

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC(=O)C3=CC=C(S3)Cl)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC(=O)C3=CC=C(S3)Cl)Cl

InChI

InChI=1S/C17H14Cl2O5S/c18-12-5-10-7-22-9-24-17(10)11(6-12)8-23-16(21)4-1-13(20)14-2-3-15(19)25-14/h2-3,5-6H,1,4,7-9H2