[2-[2-(2-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-[2-(2-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-[2-(2-fluorobenzoyl)hydrazino]-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [2-[[(2-fluorophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-fluorobenzoyl)hydrazinyl]-2-oxoethyl] 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [2-[N'-(2-fluorobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H20FN3O4/c1-3-17-13(2)20(15-9-5-7-11-18(15)24-17)22(29)30-12-19(27)25-26-21(28)14-8-4-6-10-16(14)23/h4-11H,3,12H2,1-2H3,(H,25,27)(H,26,28)