[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] 7-fluoranyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] 7-fluoranyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl] 7-fluoro-3-methyl-benzofuran-2-carboxylate CAS Name: 7-fluoro-3-methyl-2-benzofurancarboxylic acid [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] 7-fluoro-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 7-fluoro-3-methyl-coumarilic acid [2-keto-2-[2-(o-tolyl)ethylamino]ethyl] ester Formula: C21H20FNO4 MolecularWeight: 369.386203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)COC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)COC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C

InChI

InChI=1S/C21H20FNO4/c1-13-6-3-4-7-15(13)10-11-23-18(24)12-26-21(25)19-14(2)16-8-5-9-17(22)20(16)27-19/h3-9H,10-12H2,1-2H3,(H,23,24)