[(3R,3aR)-3-oxidanyl-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone

Systemtic Name: [(3R,3aR)-3-oxidanyl-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone Openeye Name: [(3R,3aR)-3-hydroxy-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone CAS Name: [(3R,3aR)-3-hydroxy-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone IUPAC Name: [(3R,3aR)-3-hydroxy-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone Traditional Name: [(3R,3aR)-3-hydroxy-3-(trifluoromethyl)-1,3a,4,5,6,7-hexahydrocyclohepta[c]pyrazol-2-yl]-(2-bromophenyl)methanone Formula: C16H16BrF3N2O2 MolecularWeight: 405.20965

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(=CC1)NN(C2(C(F)(F)F)O)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CC[C@@H]2C(=CC1)NN([C@@]2(C(F)(F)F)O)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C16H16BrF3N2O2/c17-12-8-5-4-6-10(12)14(23)22-15(24,16(18,19)20)11-7-2-1-3-9-13(11)21-22/h4-6,8-9,11,21,24H,1-3,7H2/t11-,15-/m1/s1