2-piperazin-1-yl-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-dione

Systemtic Name: 2-piperazin-1-yl-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-dione Openeye Name: 2-piperazin-1-yl-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-dione CAS Name: 2-(1-piperazinyl)-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-dione IUPAC Name: 2-piperazin-1-yl-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-dione Traditional Name: 2-piperazino-3-[3-(trifluoromethyl)phenyl]quinoline-5,8-quinone Formula: C20H16F3N3O2 MolecularWeight: 387.35515

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C=C2C4=CC(=CC=C4)C(F)(F)F)C(=O)C=CC3=O

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C=C2C4=CC(=CC=C4)C(F)(F)F)C(=O)C=CC3=O

InChI

InChI=1S/C20H16F3N3O2/c21-20(22,23)13-3-1-2-12(10-13)14-11-15-16(27)4-5-17(28)18(15)25-19(14)26-8-6-24-7-9-26/h1-5,10-11,24H,6-9H2