[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate CAS Name: 3-ethyl-2-propyl-4-quinolinecarboxylic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3-ethyl-2-propylquinoline-4-carboxylate Traditional Name: 3-ethyl-2-propyl-cinchoninic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C24H25FN2O3 MolecularWeight: 408.465303

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H25FN2O3/c1-3-7-20-18(4-2)23(19-8-5-6-9-21(19)27-20)24(29)30-15-22(28)26-14-16-10-12-17(25)13-11-16/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,26,28)