diethyl 4-[(3-chloranyl-2-methyl-phenyl)amino]quinoline-3,6-dicarboxylate

Systemtic Name: diethyl 4-[(3-chloranyl-2-methyl-phenyl)amino]quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-(3-chloro-2-methyl-anilino)quinoline-3,6-dicarboxylate CAS Name: 4-(3-chloro-2-methylanilino)quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3-chloro-2-methylanilino)quinoline-3,6-dicarboxylate Traditional Name: 4-(3-chloro-2-methyl-anilino)quinoline-3,6-dicarboxylic acid diethyl ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN2O4/c1-4-28-21(26)14-9-10-19-15(11-14)20(16(12-24-19)22(27)29-5-2)25-18-8-6-7-17(23)13(18)3/h6-12H,4-5H2,1-3H3,(H,24,25)