[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4/c1-3-17-20(14(2)16-11-7-8-12-18(16)23-17)22(28)29-13-19(26)24-25-21(27)15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3,(H,24,26)(H,25,27)