2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 2-[[4-(2-hydroxyphenyl)-1-piperazinyl]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 2-[[4-(2-hydroxyphenyl)piperazino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C20H19F3N4O2 MolecularWeight: 404.38567

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F)C4=CC=CC=C4O

InChI

InChI=1S/C20H19F3N4O2/c21-20(22,23)13-5-6-14-15(11-13)24-18(25-19(14)29)12-26-7-9-27(10-8-26)16-3-1-2-4-17(16)28/h1-6,11,28H,7-10,12H2,(H,24,25,29)