4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

Systemtic Name: 4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Openeye Name: 4-methyl-2-(tetralin-6-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one CAS Name: 4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one IUPAC Name: 4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Traditional Name: 4-methyl-2-(tetralin-6-ylmethyl)-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C16H17F3N2O MolecularWeight: 310.31419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)CC2=CC3=C(CCCC3)C=C2)C(F)(F)F

Isomeric SMILES

CC1=C(NN(C1=O)CC2=CC3=C(CCCC3)C=C2)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O/c1-10-14(16(17,18)19)20-21(15(10)22)9-11-6-7-12-4-2-3-5-13(12)8-11/h6-8,20H,2-5,9H2,1H3