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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)N2C=CC3=C(C2=O)C=CC=C3C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)N2C=CC3=C(C2=O)C=CC=C3C(F)(F)F

InChI

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