dimethyl 5,6,7-tris(chloranyl)-4-oxidanyl-quinoline-1,4-dicarboxylate

Systemtic Name: dimethyl 5,6,7-tris(chloranyl)-4-oxidanyl-quinoline-1,4-dicarboxylate Openeye Name: dimethyl 5,6,7-trichloro-4-hydroxy-quinoline-1,4-dicarboxylate CAS Name: 5,6,7-trichloro-4-hydroxyquinoline-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5,6,7-trichloro-4-hydroxyquinoline-1,4-dicarboxylate Traditional Name: 5,6,7-trichloro-4-hydroxy-quinoline-1,4-dicarboxylic acid dimethyl ester Formula: C13H10Cl3NO5 MolecularWeight: 366.5812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C=CN(C2=CC(=C(C(=C21)Cl)Cl)Cl)C(=O)OC)O

Isomeric SMILES

COC(=O)C1(C=CN(C2=CC(=C(C(=C21)Cl)Cl)Cl)C(=O)OC)O

InChI

InChI=1S/C13H10Cl3NO5/c1-21-11(18)13(20)3-4-17(12(19)22-2)7-5-6(14)9(15)10(16)8(7)13/h3-5,20H,1-2H3