ethyl 4-[(5-acetamido-2-chloranyl-phenyl)amino]-8-cyano-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(5-acetamido-2-chloranyl-phenyl)amino]-8-cyano-quinoline-3-carboxylate Openeye Name: ethyl 4-(5-acetamido-2-chloro-anilino)-8-cyano-quinoline-3-carboxylate CAS Name: 4-(5-acetamido-2-chloroanilino)-8-cyano-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-acetamido-2-chloroanilino)-8-cyanoquinoline-3-carboxylate Traditional Name: 4-(5-acetamido-2-chloro-anilino)-8-cyano-quinoline-3-carboxylic acid ethyl ester Formula: C21H17ClN4O3 MolecularWeight: 408.83768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC(=C2N=C1)C#N)NC3=C(C=CC(=C3)NC(=O)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC(=C2N=C1)C#N)NC3=C(C=CC(=C3)NC(=O)C)Cl

InChI

InChI=1S/C21H17ClN4O3/c1-3-29-21(28)16-11-24-19-13(10-23)5-4-6-15(19)20(16)26-18-9-14(25-12(2)27)7-8-17(18)22/h4-9,11H,3H2,1-2H3,(H,24,26)(H,25,27)