3-(1-methyl-3-oxidanyl-piperidin-4-yl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one

Systemtic Name: 3-(1-methyl-3-oxidanyl-piperidin-4-yl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one Openeye Name: 3-(3-hydroxy-1-methyl-4-piperidyl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one CAS Name: 3-(3-hydroxy-1-methyl-4-piperidinyl)-2-[1-phenyl-5-(trifluoromethyl)-4-pyrazolyl]-1-benzopyran-4-one IUPAC Name: 3-(3-hydroxy-1-methylpiperidin-4-yl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one Traditional Name: 3-(3-hydroxy-1-methyl-4-piperidyl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromone Formula: C25H22F3N3O3 MolecularWeight: 469.45569

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)O)C2=C(OC3=CC=CC=C3C2=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

CN1CCC(C(C1)O)C2=C(OC3=CC=CC=C3C2=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C25H22F3N3O3/c1-30-12-11-16(19(32)14-30)21-22(33)17-9-5-6-10-20(17)34-23(21)18-13-29-31(24(18)25(26,27)28)15-7-3-2-4-8-15/h2-10,13,16,19,32H,11-12,14H2,1H3