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2-methyl-4-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]carbonyl-phthalazin-1-one

2-methyl-4-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name:2-methyl-4-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]carbonyl-phthalazin-1-one
Openeye Name:2-methyl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one
CAS Name:2-methyl-4-[oxo-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methyl]-1-phthalazinone
IUPAC Name:2-methyl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one
Traditional Name:2-methyl-4-[4-[4-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phthalazin-1-one
Formula: C22H19F3N4O3
MolecularWeight: 444.40647
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F


Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F


InChI

InChI=1S/C22H19F3N4O3/c1-27-20(31)17-5-3-2-4-16(17)18(26-27)21(32)29-12-10-28(11-13-29)19(30)14-6-8-15(9-7-14)22(23,24)25/h2-9H,10-13H2,1H3


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