(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-thiophen-2-ylbutanoate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-thiophen-2-ylbutanoate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 4-(2-thienyl)butanoate CAS Name: 4-thiophen-2-ylbutanoic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 4-thiophen-2-ylbutanoate Traditional Name: 4-(2-thienyl)butyric acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCCC3=CC=CS3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCCC3=CC=CS3)O

InChI

InChI=1S/C20H20O5S/c1-2-13-9-16-14(10-20(23)25-18(16)11-17(13)21)12-24-19(22)7-3-5-15-6-4-8-26-15/h4,6,8-11,21H,2-3,5,7,12H2,1H3