(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate CAS Name: 6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate Traditional Name: 6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxylic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C24H20ClN3O5 MolecularWeight: 465.8857

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3O5/c1-31-19-8-7-16-13-17(23(25)26-21(16)14-19)15-33-24(30)20-9-10-22(29)28(27-20)11-12-32-18-5-3-2-4-6-18/h2-10,13-14H,11-12,15H2,1H3