6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)-1-piperidyl]methyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)-1-piperidinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)piperidin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[[(3R)-3-(trifluoromethyl)piperidino]methyl]-1H-quinazolin-4-one Formula: C17H20F3N3O3 MolecularWeight: 371.35421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCCC(C3)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCC[C@H](C3)C(F)(F)F)OC

InChI

InChI=1S/C17H20F3N3O3/c1-25-13-6-11-12(7-14(13)26-2)21-15(22-16(11)24)9-23-5-3-4-10(8-23)17(18,19)20/h6-7,10H,3-5,8-9H2,1-2H3,(H,21,22,24)/t10-/m1/s1