6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]quinazoline

Systemtic Name: 6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]quinazoline Openeye Name: 6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]quinazoline CAS Name: 6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]-1-pyrrolidinyl]quinazoline IUPAC Name: 6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]quinazoline Traditional Name: 6,7-dimethoxy-4-[(3R)-3-[2-(trifluoromethyl)phenoxy]pyrrolidino]quinazoline Formula: C21H20F3N3O3 MolecularWeight: 419.39701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(C3)OC4=CC=CC=C4C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CC[C@H](C3)OC4=CC=CC=C4C(F)(F)F)OC

InChI

InChI=1S/C21H20F3N3O3/c1-28-18-9-14-16(10-19(18)29-2)25-12-26-20(14)27-8-7-13(11-27)30-17-6-4-3-5-15(17)21(22,23)24/h3-6,9-10,12-13H,7-8,11H2,1-2H3/t13-/m1/s1