[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate CAS Name: 3-ethyl-2-propyl-4-quinolinecarboxylic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 3-ethyl-2-propylquinoline-4-carboxylate Traditional Name: 3-ethyl-2-propyl-cinchoninic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C28H33N3O3/c1-3-10-24-22(4-2)27(23-11-6-7-12-25(23)30-24)28(33)34-19-26(32)29-20-13-15-21(16-14-20)31-17-8-5-9-18-31/h6-7,11-16H,3-5,8-10,17-19H2,1-2H3,(H,29,32)