[2-[1-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[1-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-[1-(4-fluorophenyl)ethylamino]-2-oxo-ethyl] 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid [2-[1-(4-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-fluorophenyl)ethylamino]-2-oxoethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid [2-[1-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C22H22FNO5 MolecularWeight: 399.412183

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NC(C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NC(C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FNO5/c1-3-27-12-18-17-6-4-5-7-19(17)29-21(18)22(26)28-13-20(25)24-14(2)15-8-10-16(23)11-9-15/h4-11,14H,3,12-13H2,1-2H3,(H,24,25)