cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]cyclohexan-1-one

Systemtic Name: cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]cyclohexan-1-one Openeye Name: cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]cyclohexanone CAS Name: cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]-1-cyclohexanone IUPAC Name: cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]cyclohexan-1-one Traditional Name: cyclohexanone; 4-[5-(trifluoromethyl)-1H-indol-3-yl]cyclohexanone Formula: C21H24F3NO2 MolecularWeight: 379.41597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)CC1.C1CC(=O)CCC1C2=CNC3=C2C=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCC(=O)CC1.C1CC(=O)CCC1C2=CNC3=C2C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C15H14F3NO.C6H10O/c16-15(17,18)10-3-6-14-12(7-10)13(8-19-14)9-1-4-11(20)5-2-9;7-6-4-2-1-3-5-6/h3,6-9,19H,1-2,4-5H2;1-5H2