[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[bis(fluoranyl)methoxy]-3-ethoxy-benzoate

Systemtic Name: [(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[bis(fluoranyl)methoxy]-3-ethoxy-benzoate Openeye Name: [(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 4-(difluoromethoxy)-3-ethoxy-benzoate CAS Name: 4-(difluoromethoxy)-3-ethoxybenzoic acid [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] 4-(difluoromethoxy)-3-ethoxybenzoate Traditional Name: 4-(difluoromethoxy)-3-ethoxy-benzoic acid [(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H18F2N2O5 MolecularWeight: 404.364126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC(=C2)C#N)OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)O[C@H](C)C(=O)NC2=CC=CC(=C2)C#N)OC(F)F

InChI

InChI=1S/C20H18F2N2O5/c1-3-27-17-10-14(7-8-16(17)29-20(21)22)19(26)28-12(2)18(25)24-15-6-4-5-13(9-15)11-23/h4-10,12,20H,3H2,1-2H3,(H,24,25)/t12-/m1/s1