ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-3-cyano-quinoline-4-carboxylate

Systemtic Name: ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-3-cyano-quinoline-4-carboxylate Openeye Name: ethyl 3-cyano-8-[(2,6-dichlorobenzoyl)amino]quinoline-4-carboxylate CAS Name: 3-cyano-8-[[(2,6-dichlorophenyl)-oxomethyl]amino]-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-8-[(2,6-dichlorobenzoyl)amino]quinoline-4-carboxylate Traditional Name: 3-cyano-8-[(2,6-dichlorobenzoyl)amino]cinchoninic acid ethyl ester Formula: C20H13Cl2N3O3 MolecularWeight: 414.24152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=C(C2=NC=C1C#N)NC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C2C=CC=C(C2=NC=C1C#N)NC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C20H13Cl2N3O3/c1-2-28-20(27)16-11(9-23)10-24-18-12(16)5-3-8-15(18)25-19(26)17-13(21)6-4-7-14(17)22/h3-8,10H,2H2,1H3,(H,25,26)