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

Systemtic Name: 2-(4-tert-butylphenyl)-3-cyclohexyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 2-(4-tert-butylphenyl)-3-cyclohexyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 2-(4-tert-butylphenyl)-3-cyclohexyl-10-methylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 2-(4-tert-butylphenyl)-3-cyclohexyl-10-methylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 2-(4-tert-butylphenyl)-3-cyclohexyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4N3C)C(=O)N2C5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4N3C)C(=O)N2C5CCCCC5

InChI

InChI=1S/C28H31N3O2/c1-28(2,3)19-16-14-18(15-17-19)25-29-26-23(27(33)31(25)20-10-6-5-7-11-20)24(32)21-12-8-9-13-22(21)30(26)4/h8-9,12-17,20H,5-7,10-11H2,1-4H3