6-ethyl-7-oxidanyl-8-[phenyl(piperidin-1-yl)methyl]-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 6-ethyl-7-oxidanyl-8-[phenyl(piperidin-1-yl)methyl]-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-4-one Openeye Name: 6-ethyl-7-hydroxy-8-[phenyl(1-piperidyl)methyl]-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-4-one CAS Name: 6-ethyl-7-hydroxy-8-[phenyl(1-piperidinyl)methyl]-3-(1-phenyl-4-pyrazolyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-7-hydroxy-8-[phenyl(piperidin-1-yl)methyl]-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-4-one Traditional Name: 6-ethyl-7-hydroxy-8-[phenyl(piperidino)methyl]-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromone Formula: C33H30F3N3O3 MolecularWeight: 573.60481

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)N6CCCCC6)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)N6CCCCC6)O

InChI

InChI=1S/C33H30F3N3O3/c1-2-21-18-25-30(41)26(23-19-37-39(20-23)24-14-8-4-9-15-24)32(33(34,35)36)42-31(25)27(29(21)40)28(22-12-6-3-7-13-22)38-16-10-5-11-17-38/h3-4,6-9,12-15,18-20,28,40H,2,5,10-11,16-17H2,1H3