3-[4-[[5-oxidanylidene-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]piperidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-[[5-oxidanylidene-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[[5-oxo-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]piperidine-1-carbonyl]benzonitrile CAS Name: 3-[oxo-[4-[[5-oxo-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 3-[4-[[5-oxo-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]piperidine-1-carbonyl]benzonitrile Traditional Name: 3-[4-[[5-keto-2-(trifluoromethyl)-1,6-naphthyridin-6-yl]methyl]piperidine-1-carbonyl]benzonitrile Formula: C23H19F3N4O2 MolecularWeight: 440.41777

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=CC3=C(C2=O)C=CC(=N3)C(F)(F)F)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1CN2C=CC3=C(C2=O)C=CC(=N3)C(F)(F)F)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H19F3N4O2/c24-23(25,26)20-5-4-18-19(28-20)8-11-30(22(18)32)14-15-6-9-29(10-7-15)21(31)17-3-1-2-16(12-17)13-27/h1-5,8,11-12,15H,6-7,9-10,14H2