methyl 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxylate

Systemtic Name: methyl 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxylate Openeye Name: methyl 2-[(2-chloro-6-fluoro-phenyl)methyl]-3-oxo-5,6-diphenyl-pyridazine-4-carboxylate CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-5,6-diphenyl-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-5,6-diphenylpyridazine-4-carboxylate Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-3-keto-5,6-diphenyl-pyridazine-4-carboxylic acid methyl ester Formula: C25H18ClFN2O3 MolecularWeight: 448.873423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NN(C1=O)CC2=C(C=CC=C2Cl)F)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C(=NN(C1=O)CC2=C(C=CC=C2Cl)F)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H18ClFN2O3/c1-32-25(31)22-21(16-9-4-2-5-10-16)23(17-11-6-3-7-12-17)28-29(24(22)30)15-18-19(26)13-8-14-20(18)27/h2-14H,15H2,1H3