7-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-[[4-[3-(trifluoromethyl)phenyl]piperazino]methyl]coumarin Formula: C21H19F3N2O2 MolecularWeight: 388.38297

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)C=CC(=O)O3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)C=CC(=O)O3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H19F3N2O2/c22-21(23,24)17-2-1-3-18(13-17)26-10-8-25(9-11-26)14-15-4-5-16-6-7-20(27)28-19(16)12-15/h1-7,12-13H,8-11,14H2