1-ethyl-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-6-(trifluoromethyl)quinolin-4-one

Systemtic Name: 1-ethyl-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-6-(trifluoromethyl)quinolin-4-one Openeye Name: 3-(4-benzylpiperidine-1-carbonyl)-1-ethyl-6-(trifluoromethyl)quinolin-4-one CAS Name: 1-ethyl-3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-6-(trifluoromethyl)-4-quinolinone IUPAC Name: 3-(4-benzylpiperidine-1-carbonyl)-1-ethyl-6-(trifluoromethyl)quinolin-4-one Traditional Name: 3-(4-benzylpiperidine-1-carbonyl)-1-ethyl-6-(trifluoromethyl)-4-quinolone Formula: C25H25F3N2O2 MolecularWeight: 442.47341

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H25F3N2O2/c1-2-29-16-21(23(31)20-15-19(25(26,27)28)8-9-22(20)29)24(32)30-12-10-18(11-13-30)14-17-6-4-3-5-7-17/h3-9,15-16,18H,2,10-14H2,1H3