ethyl 4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-ethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-ethoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-(4-chloro-2-methoxy-5-methyl-anilino)-6-ethoxy-quinoline-3-carboxylate CAS Name: 4-(4-chloro-2-methoxy-5-methylanilino)-6-ethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chloro-2-methoxy-5-methylanilino)-6-ethoxyquinoline-3-carboxylate Traditional Name: 4-(4-chloro-2-methoxy-5-methyl-anilino)-6-ethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=C(C(=C3)C)Cl)OC

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=C(C(=C3)C)Cl)OC

InChI

InChI=1S/C22H23ClN2O4/c1-5-28-14-7-8-18-15(10-14)21(16(12-24-18)22(26)29-6-2)25-19-9-13(3)17(23)11-20(19)27-4/h7-12H,5-6H2,1-4H3,(H,24,25)