(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 1-(3-chloro-4-methyl-phenyl)-6-oxo-4,5-dihydropyridazine-3-carboxylate CAS Name: 1-(3-chloro-4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 1-(3-chloro-4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxylate Traditional Name: 1-(3-chloro-4-methyl-phenyl)-6-keto-4,5-dihydropyridazine-3-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C22H17ClN2O6 MolecularWeight: 440.83318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O)Cl

InChI

InChI=1S/C22H17ClN2O6/c1-12-2-3-14(9-17(12)23)25-20(27)7-6-18(24-25)22(29)30-11-13-8-21(28)31-19-10-15(26)4-5-16(13)19/h2-5,8-10,26H,6-7,11H2,1H3