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

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (6-chloro-7-ethyl-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-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-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-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H16Cl2O5S MolecularWeight: 439.30904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC(=O)C3=CC=C(S3)Cl)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC(=O)C3=CC=C(S3)Cl)Cl

InChI

InChI=1S/C20H16Cl2O5S/c1-2-11-7-16-13(9-14(11)21)12(8-20(25)27-16)10-26-19(24)6-3-15(23)17-4-5-18(22)28-17/h4-5,7-9H,2-3,6,10H2,1H3