4-oxidanyl-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 4-oxidanyl-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 4-hydroxy-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 4-hydroxy-3-(1-phenyl-4-pyrazolyl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 4-hydroxy-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 4-hydroxy-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C19H15F3N2O3 MolecularWeight: 376.32921

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=C(OC2CC1=O)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4)O

Isomeric SMILES

C1CC2=C(C(=C(OC2CC1=O)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C19H15F3N2O3/c20-19(21,22)18-16(17(26)14-7-6-13(25)8-15(14)27-18)11-9-23-24(10-11)12-4-2-1-3-5-12/h1-5,9-10,15,26H,6-8H2