methyl 4-[[2-(4-chlorophenyl)quinolin-4-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-(4-chlorophenyl)quinolin-4-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-(4-chlorophenyl)quinoline-4-carbonyl]amino]butanoate CAS Name: 4-[[[2-(4-chlorophenyl)-4-quinolinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-chlorophenyl)quinoline-4-carbonyl]amino]butanoate Traditional Name: 4-[[2-(4-chlorophenyl)quinoline-4-carbonyl]amino]butyric acid methyl ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O3/c1-27-20(25)7-4-12-23-21(26)17-13-19(14-8-10-15(22)11-9-14)24-18-6-3-2-5-16(17)18/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,23,26)