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

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H16N2O6S/c1-25-13-4-5-14-12(9-19(24)27-15(14)10-13)11-26-18(23)7-6-17-21-20(22-28-17)16-3-2-8-29-16/h2-5,8-10H,6-7,11H2,1H3