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

Systemtic Name: 8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline Openeye Name: 8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline CAS Name: 8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline IUPAC Name: 8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline Traditional Name: 8,9-dimethoxy-5,5-dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazol[3,4-a]isoquinoline Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=CC=C4[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C3=NN=C(N31)C4=CC=CC=C4[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C20H20N4O4/c1-20(2)11-12-9-16(27-3)17(28-4)10-14(12)19-22-21-18(23(19)20)13-7-5-6-8-15(13)24(25)26/h5-10H,11H2,1-4H3