[2-[[3,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: [2-[[3,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [2-(3,5-difluoroanilino)-2-oxo-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid [2-(3,5-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-difluoroanilino)-2-oxoethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [2-(3,5-difluoroanilino)-2-keto-ethyl] ester Formula: C20H21F2NO6 MolecularWeight: 409.380646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC(=O)NC2=CC(=CC(=C2)F)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC(=O)NC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C20H21F2NO6/c1-26-16-6-12(7-17(27-2)20(16)28-3)4-5-19(25)29-11-18(24)23-15-9-13(21)8-14(22)10-15/h6-10H,4-5,11H2,1-3H3,(H,23,24)