(4-pyrrolidin-1-ylcarbonylphenyl)methyl 1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]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 [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]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 [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C24H24ClN3O4 MolecularWeight: 453.91806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4)Cl

InChI

InChI=1S/C24H24ClN3O4/c1-16-4-9-19(14-20(16)25)28-22(29)11-10-21(26-28)24(31)32-15-17-5-7-18(8-6-17)23(30)27-12-2-3-13-27/h4-9,14H,2-3,10-13,15H2,1H3