[1-[(4-chloranyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(furan-2-ylmethylamino)benzoate

Systemtic Name: [1-[(4-chloranyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(furan-2-ylmethylamino)benzoate Openeye Name: [2-(4-chloro-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] 2-(2-furylmethylamino)benzoate CAS Name: 2-(2-furanylmethylamino)benzoic acid [1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] 2-(furan-2-ylmethylamino)benzoate Traditional Name: 2-(2-furfurylamino)benzoic acid [2-(4-chloro-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C21H18ClFN2O4 MolecularWeight: 416.830023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)F)OC(=O)C2=CC=CC=C2NCC3=CC=CO3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)F)OC(=O)C2=CC=CC=C2NCC3=CC=CO3

InChI

InChI=1S/C21H18ClFN2O4/c1-13(20(26)25-19-9-8-14(22)11-17(19)23)29-21(27)16-6-2-3-7-18(16)24-12-15-5-4-10-28-15/h2-11,13,24H,12H2,1H3,(H,25,26)