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

Systemtic Name: 2-cyclohexyl-3-(3,5-dimethylphenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 2-cyclohexyl-3-(3,5-dimethylphenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 2-cyclohexyl-3-(3,5-dimethylphenyl)-10-methylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 2-cyclohexyl-3-(3,5-dimethylphenyl)-10-methylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 2-cyclohexyl-3-(3,5-dimethylphenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4N3C)C5CCCCC5)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4N3C)C5CCCCC5)C

InChI

InChI=1S/C26H27N3O2/c1-16-13-17(2)15-19(14-16)29-24(18-9-5-4-6-10-18)27-25-22(26(29)31)23(30)20-11-7-8-12-21(20)28(25)3/h7-8,11-15,18H,4-6,9-10H2,1-3H3