3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2-propan-2-yl-pyrimido[4,5-b]quinoline-4,5-dione

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2-propan-2-yl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-isopropyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2-propan-2-ylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2-propan-2-ylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 3-homoveratryl-2-isopropyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C25H27N3O4 MolecularWeight: 433.49958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C(=O)C3=CC=CC=C3N2C)C(=O)N1CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)C1=NC2=C(C(=O)C3=CC=CC=C3N2C)C(=O)N1CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H27N3O4/c1-15(2)23-26-24-21(22(29)17-8-6-7-9-18(17)27(24)3)25(30)28(23)13-12-16-10-11-19(31-4)20(14-16)32-5/h6-11,14-15H,12-13H2,1-5H3