[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)CC)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=C(C(=NC2=CC=CC=C21)CC)C

InChI

InChI=1S/C20H26N2O3/c1-5-9-13(3)21-18(23)12-25-20(24)19-14(4)16(6-2)22-17-11-8-7-10-15(17)19/h7-8,10-11,13H,5-6,9,12H2,1-4H3,(H,21,23)