3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-2H-isoquinolin-1-one

Systemtic Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-2H-isoquinolin-1-one Openeye Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-2H-isoquinolin-1-one CAS Name: 3-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)-2H-isoquinolin-1-one IUPAC Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-2H-isoquinolin-1-one Traditional Name: 3-(4-methylpiperazino)-5-(trifluoromethyl)isocarbostyril Formula: C15H16F3N3O MolecularWeight: 311.30225

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=CC=C3C(F)(F)F)C(=O)N2

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=CC=C3C(F)(F)F)C(=O)N2

InChI

InChI=1S/C15H16F3N3O/c1-20-5-7-21(8-6-20)13-9-11-10(14(22)19-13)3-2-4-12(11)15(16,17)18/h2-4,9H,5-8H2,1H3,(H,19,22)