5-[[4-(4-chloranyl-3-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentylidene]amino]-2-methyl-phthalazin-1-one

Systemtic Name: 5-[[4-(4-chloranyl-3-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentylidene]amino]-2-methyl-phthalazin-1-one Openeye Name: 5-[[4-(4-chloro-3-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentylidene]amino]-2-methyl-phthalazin-1-one CAS Name: 5-[[4-(4-chloro-3-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentylidene]amino]-2-methyl-1-phthalazinone IUPAC Name: 5-[[4-(4-chloro-3-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentylidene]amino]-2-methylphthalazin-1-one Traditional Name: 5-[[4-(4-chloro-3-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentylidene]amino]-2-methyl-phthalazin-1-one Formula: C23H23ClF3N3O3 MolecularWeight: 481.89523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C=NC1=CC=CC2=C1C=NN(C2=O)C)(C(F)(F)F)O)C3=CC(=C(C=C3)Cl)OC

Isomeric SMILES

CC(C)(CC(C=NC1=CC=CC2=C1C=NN(C2=O)C)(C(F)(F)F)O)C3=CC(=C(C=C3)Cl)OC

InChI

InChI=1S/C23H23ClF3N3O3/c1-21(2,14-8-9-17(24)19(10-14)33-4)12-22(32,23(25,26)27)13-28-18-7-5-6-15-16(18)11-29-30(3)20(15)31/h5-11,13,32H,12H2,1-4H3