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

Systemtic Name: 2-(4-tert-butylphenyl)-3-cycloheptyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 2-(4-tert-butylphenyl)-3-cycloheptyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 2-(4-tert-butylphenyl)-3-cycloheptyl-10-methylpyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 2-(4-tert-butylphenyl)-3-cycloheptyl-10-methylpyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 2-(4-tert-butylphenyl)-3-cycloheptyl-10-methyl-pyrimido[4,5-b]quinoline-4,5-quinone Formula: C29H33N3O2 MolecularWeight: 455.59122

Click to see the large picture

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)N2C5CCCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4N3C)C(=O)N2C5CCCCCC5

InChI

InChI=1S/C29H33N3O2/c1-29(2,3)20-17-15-19(16-18-20)26-30-27-24(25(33)22-13-9-10-14-23(22)31(27)4)28(34)32(26)21-11-7-5-6-8-12-21/h9-10,13-18,21H,5-8,11-12H2,1-4H3