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

Systemtic Name: ethyl 4-[(5-chloranyl-2-methoxy-phenyl)amino]-6-ethoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-(5-chloro-2-methoxy-anilino)-6-ethoxy-quinoline-3-carboxylate CAS Name: 4-(5-chloro-2-methoxyanilino)-6-ethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-chloro-2-methoxyanilino)-6-ethoxyquinoline-3-carboxylate Traditional Name: 4-(5-chloro-2-methoxy-anilino)-6-ethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O4/c1-4-27-14-7-8-17-15(11-14)20(16(12-23-17)21(25)28-5-2)24-18-10-13(22)6-9-19(18)26-3/h6-12H,4-5H2,1-3H3,(H,23,24)