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

Systemtic Name: 3-hexyl-10-methyl-2-(3,4,5-trimethoxyphenyl)pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 3-hexyl-10-methyl-2-(3,4,5-trimethoxyphenyl)pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 3-hexyl-10-methyl-2-(3,4,5-trimethoxyphenyl)pyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 3-hexyl-10-methyl-2-(3,4,5-trimethoxyphenyl)pyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 3-hexyl-10-methyl-2-(3,4,5-trimethoxyphenyl)pyrimido[4,5-b]quinoline-4,5-quinone Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3N2C)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3N2C)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C27H31N3O5/c1-6-7-8-11-14-30-25(17-15-20(33-3)24(35-5)21(16-17)34-4)28-26-22(27(30)32)23(31)18-12-9-10-13-19(18)29(26)2/h9-10,12-13,15-16H,6-8,11,14H2,1-5H3