ethyl 4-oxidanylidene-6-(3-phenylpropanoylamino)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-6-(3-phenylpropanoylamino)-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-oxo-6-(3-phenylpropanoylamino)-1H-quinoline-3-carboxylate CAS Name: 4-oxo-6-[(1-oxo-3-phenylpropyl)amino]-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-6-(3-phenylpropanoylamino)-1H-quinoline-3-carboxylate Traditional Name: 6-(hydrocinnamoylamino)-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-2-27-21(26)17-13-22-18-10-9-15(12-16(18)20(17)25)23-19(24)11-8-14-6-4-3-5-7-14/h3-7,9-10,12-13H,2,8,11H2,1H3,(H,22,25)(H,23,24)