(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H15ClO5S MolecularWeight: 390.8374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC(=O)C3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCC(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C19H15ClO5S/c1-11-7-16-13(9-14(11)20)12(8-19(23)25-16)10-24-18(22)5-4-15(21)17-3-2-6-26-17/h2-3,6-9H,4-5,10H2,1H3