[1-oxidanylidene-1-(propylamino)propan-2-yl] 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: 2-(3-pyridinyl)-4-quinolinecarboxylic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: 2-(3-pyridyl)cinchoninic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-3-10-23-20(25)14(2)27-21(26)17-12-19(15-7-6-11-22-13-15)24-18-9-5-4-8-16(17)18/h4-9,11-14H,3,10H2,1-2H3,(H,23,25)