[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC(=O)NCCCOC(C)C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC(=O)NCCCOC(C)C)C

InChI

InChI=1S/C21H28N2O4/c1-5-17-20(15(4)16-9-6-7-10-18(16)23-17)21(25)27-13-19(24)22-11-8-12-26-14(2)3/h6-7,9-10,14H,5,8,11-13H2,1-4H3,(H,22,24)