[1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: 1-[(4-fluorophenyl)carbamoyl]propyl 3-(methoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(methoxymethyl)-2-benzofurancarboxylic acid [1-(4-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-fluoroanilino)-1-oxobutan-2-yl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(methoxymethyl)coumarilic acid 1-[(4-fluorophenyl)carbamoyl]propyl ester Formula: C21H20FNO5 MolecularWeight: 385.385603

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=C(C3=CC=CC=C3O2)COC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=C(C3=CC=CC=C3O2)COC

InChI

InChI=1S/C21H20FNO5/c1-3-17(20(24)23-14-10-8-13(22)9-11-14)28-21(25)19-16(12-26-2)15-6-4-5-7-18(15)27-19/h4-11,17H,3,12H2,1-2H3,(H,23,24)