2-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-4-methyl-phthalazin-1-one

Systemtic Name: 2-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-4-methyl-phthalazin-1-one Openeye Name: 2-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-4-methyl-phthalazin-1-one CAS Name: 2-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-4-methyl-1-phthalazinone IUPAC Name: 2-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-4-methylphthalazin-1-one Traditional Name: 2-[[cyclopropyl-[4-(trifluoromethyl)benzyl]amino]methyl]-4-methyl-phthalazin-1-one Formula: C21H20F3N3O MolecularWeight: 387.39821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CN(CC3=CC=C(C=C3)C(F)(F)F)C4CC4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CN(CC3=CC=C(C=C3)C(F)(F)F)C4CC4

InChI

InChI=1S/C21H20F3N3O/c1-14-18-4-2-3-5-19(18)20(28)27(25-14)13-26(17-10-11-17)12-15-6-8-16(9-7-15)21(22,23)24/h2-9,17H,10-13H2,1H3