(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C19H14N2O6S MolecularWeight: 398.38926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C19H14N2O6S/c22-13-1-2-14-12(7-18(24)26-15(14)8-13)9-25-17(23)4-3-16-20-19(21-27-16)11-5-6-28-10-11/h1-2,5-8,10,22H,3-4,9H2