[2-[2-(2-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-cyclopropylquinoline-4-carboxylate

Systemtic Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-cyclopropylquinoline-4-carboxylate Openeye Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxo-ethyl] 2-cyclopropylquinoline-4-carboxylate CAS Name: 2-cyclopropyl-4-quinolinecarboxylic acid [2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl] 2-cyclopropylquinoline-4-carboxylate Traditional Name: 2-cyclopropylcinchoninic acid [2-[2-(2-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C23H21FN2O3 MolecularWeight: 392.422843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCC4=CC=CC=C4F

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCC4=CC=CC=C4F

InChI

InChI=1S/C23H21FN2O3/c24-19-7-3-1-5-15(19)11-12-25-22(27)14-29-23(28)18-13-21(16-9-10-16)26-20-8-4-2-6-17(18)20/h1-8,13,16H,9-12,14H2,(H,25,27)