methyl 2,2-bis(fluoranyl)-3-[[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 2,2-bis(fluoranyl)-3-[[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 2,2-difluoro-3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)vinyl]sulfonylmethyl]anilino]-3-oxo-propanoate CAS Name: 2,2-difluoro-3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2,2-difluoro-3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]anilino]-3-oxopropanoate Traditional Name: 2,2-difluoro-3-keto-3-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)vinyl]sulfonylmethyl]anilino]propionic acid methyl ester Formula: C23H25F2NO9S MolecularWeight: 529.507706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CS(=O)(=O)C=CC2=C(C=C(C=C2OC)OC)OC)NC(=O)C(C(=O)OC)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)CS(=O)(=O)/C=C/C2=C(C=C(C=C2OC)OC)OC)NC(=O)C(C(=O)OC)(F)F

InChI

InChI=1S/C23H25F2NO9S/c1-31-15-11-19(33-3)16(20(12-15)34-4)8-9-36(29,30)13-14-6-7-18(32-2)17(10-14)26-21(27)23(24,25)22(28)35-5/h6-12H,13H2,1-5H3,(H,26,27)/b9-8+