4-[(5-bromanylnaphthalen-2-yl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(5-bromanylnaphthalen-2-yl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-[(5-bromo-2-naphthyl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(5-bromo-2-naphthalenyl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(5-bromonaphthalen-2-yl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-[(5-bromo-2-naphthyl)methyl]-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C15H10BrF3N2O MolecularWeight: 371.15191

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)CC3=C(NNC3=O)C(F)(F)F)C(=C1)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2)CC3=C(NNC3=O)C(F)(F)F)C(=C1)Br

InChI

InChI=1S/C15H10BrF3N2O/c16-12-3-1-2-9-6-8(4-5-10(9)12)7-11-13(15(17,18)19)20-21-14(11)22/h1-6H,7H2,(H2,20,21,22)