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

Systemtic Name: 3-cyclohexyl-2-(2,4-dichlorophenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 3-cyclohexyl-2-(2,4-dichlorophenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 3-cyclohexyl-2-(2,4-dichlorophenyl)-10-methylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 3-cyclohexyl-2-(2,4-dichlorophenyl)-10-methylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 3-cyclohexyl-2-(2,4-dichlorophenyl)-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C24H21Cl2N3O2 MolecularWeight: 454.34844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C3=C1N=C(N(C3=O)C4CCCCC4)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C3=C1N=C(N(C3=O)C4CCCCC4)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H21Cl2N3O2/c1-28-19-10-6-5-9-17(19)21(30)20-23(28)27-22(16-12-11-14(25)13-18(16)26)29(24(20)31)15-7-3-2-4-8-15/h5-6,9-13,15H,2-4,7-8H2,1H3