8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline

Systemtic Name: 8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline Openeye Name: 8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline CAS Name: 8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline IUPAC Name: 8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline Traditional Name: 8,9-dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazol[3,4-a]isoquinoline Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=CC=C4)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=CC=C4)OC)OC)C

InChI

InChI=1S/C20H21N3O2/c1-20(2)12-14-10-16(24-3)17(25-4)11-15(14)19-22-21-18(23(19)20)13-8-6-5-7-9-13/h5-11H,12H2,1-4H3