8-[(3S,4R)-1-methyl-3-oxidanyl-piperidin-4-yl]-5,7-bis(oxidanyl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one

Systemtic Name: 8-[(3S,4R)-1-methyl-3-oxidanyl-piperidin-4-yl]-5,7-bis(oxidanyl)-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one Openeye Name: 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidyl]-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one CAS Name: 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidinyl]-2-[1-phenyl-5-(trifluoromethyl)-4-pyrazolyl]-1-benzopyran-4-one IUPAC Name: 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromen-4-one Traditional Name: 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidyl]-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]chromone Formula: C25H22F3N3O5 MolecularWeight: 501.45449

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F)O)O

Isomeric SMILES

CN1CC[C@@H]([C@@H](C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F)O)O

InChI

InChI=1S/C25H22F3N3O5/c1-30-8-7-14(19(35)12-30)21-16(32)9-17(33)22-18(34)10-20(36-23(21)22)15-11-29-31(24(15)25(26,27)28)13-5-3-2-4-6-13/h2-6,9-11,14,19,32-33,35H,7-8,12H2,1H3/t14-,19+/m0/s1