3-(3-chlorophenyl)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one hydrobromide

Systemtic Name: 3-(3-chlorophenyl)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one hydrobromide Openeye Name: 3-(3-chlorophenyl)-7-hydroxy-8-(1-piperidylmethyl)-2-(trifluoromethyl)chromen-4-one hydrobromide CAS Name: 3-(3-chlorophenyl)-7-hydroxy-8-(1-piperidinylmethyl)-2-(trifluoromethyl)-1-benzopyran-4-one hydrobromide IUPAC Name: 3-(3-chlorophenyl)-7-hydroxy-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one hydrobromide Traditional Name: 3-(3-chlorophenyl)-7-hydroxy-8-(piperidinomethyl)-2-(trifluoromethyl)chromone hydrobromide Formula: C22H20BrClF3NO3 MolecularWeight: 518.75131

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC(=CC=C4)Cl)C(F)(F)F)O.Br

Isomeric SMILES

C1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC(=CC=C4)Cl)C(F)(F)F)O.Br

InChI

InChI=1S/C22H19ClF3NO3.BrH/c23-14-6-4-5-13(11-14)18-19(29)15-7-8-17(28)16(12-27-9-2-1-3-10-27)20(15)30-21(18)22(24,25)26;/h4-8,11,28H,1-3,9-10,12H2;1H