7-methoxy-4-[[4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[[4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-methoxy-4-[[4-[[4-(trifluoromethoxy)phenyl]methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-methoxy-4-[[4-[4-(trifluoromethoxy)benzyl]piperazino]methyl]coumarin Formula: C23H23F3N2O4 MolecularWeight: 448.43493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C23H23F3N2O4/c1-30-19-6-7-20-17(12-22(29)31-21(20)13-19)15-28-10-8-27(9-11-28)14-16-2-4-18(5-3-16)32-23(24,25)26/h2-7,12-13H,8-11,14-15H2,1H3