3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]propan-1-one Formula: C16H17F3N2O4 MolecularWeight: 358.31239

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17F3N2O4/c1-2-11-8-15(23,16(17,18)19)21(20-11)14(22)6-4-10-3-5-12-13(7-10)25-9-24-12/h3,5,7,23H,2,4,6,8-9H2,1H3