ethyl 8-chloranyl-5-[2-(4-methylphenyl)ethyl]-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 8-chloranyl-5-[2-(4-methylphenyl)ethyl]-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 8-chloro-4-oxo-5-[2-(p-tolyl)ethyl]-1H-quinoline-3-carboxylate CAS Name: 8-chloro-5-[2-(4-methylphenyl)ethyl]-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-chloro-5-[2-(4-methylphenyl)ethyl]-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 8-chloro-4-keto-5-[2-(p-tolyl)ethyl]-1H-quinoline-3-carboxylic acid ethyl ester Formula: C21H20ClNO3 MolecularWeight: 369.8414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=CC(=C2C1=O)CCC3=CC=C(C=C3)C)Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=CC(=C2C1=O)CCC3=CC=C(C=C3)C)Cl

InChI

InChI=1S/C21H20ClNO3/c1-3-26-21(25)16-12-23-19-17(22)11-10-15(18(19)20(16)24)9-8-14-6-4-13(2)5-7-14/h4-7,10-12H,3,8-9H2,1-2H3,(H,23,24)