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

Systemtic Name: 2-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 2-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 2-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 2-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 2-cyclohexyl-3-homoveratryl-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C3=C1N=C(N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C5CCCCC5

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C3=C1N=C(N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C5CCCCC5

InChI

InChI=1S/C28H31N3O4/c1-30-21-12-8-7-11-20(21)25(32)24-27(30)29-26(19-9-5-4-6-10-19)31(28(24)33)16-15-18-13-14-22(34-2)23(17-18)35-3/h7-8,11-14,17,19H,4-6,9-10,15-16H2,1-3H3