[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl] 2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid [2-(4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl] 2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid [2-(4-fluoroanilino)-2-keto-ethyl] ester Formula: C23H19FN2O5 MolecularWeight: 422.405763

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)OCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)OCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN2O5/c24-17-7-9-18(10-8-17)25-21(27)14-31-23(29)19-12-15-4-1-2-5-16(15)13-26(19)22(28)20-6-3-11-30-20/h1-11,19H,12-14H2,(H,25,27)