6,7-dimethoxy-N-[4-(trifluoromethyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine

Systemtic Name: 6,7-dimethoxy-N-[4-(trifluoromethyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine Openeye Name: 6,7-dimethoxy-N-[4-(trifluoromethyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine CAS Name: 6,7-dimethoxy-N-[4-(trifluoromethyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine IUPAC Name: 6,7-dimethoxy-N-[4-(trifluoromethyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine Traditional Name: (6,7-dimethoxy-1,4,4a,8a-tetrahydroquinazolin-2-yl)-[4-(trifluoromethyl)phenyl]amine Formula: C17H18F3N3O2 MolecularWeight: 353.33893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2CN=C(NC2C=C1OC)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=CC2CN=C(NC2C=C1OC)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H18F3N3O2/c1-24-14-7-10-9-21-16(23-13(10)8-15(14)25-2)22-12-5-3-11(4-6-12)17(18,19)20/h3-8,10,13H,9H2,1-2H3,(H2,21,22,23)