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

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCCOC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCCOC(C)C

InChI

InChI=1S/C25H28N2O4/c1-17(2)30-14-6-13-26-24(28)16-31-25(29)21-15-23(19-11-9-18(3)10-12-19)27-22-8-5-4-7-20(21)22/h4-5,7-12,15,17H,6,13-14,16H2,1-3H3,(H,26,28)