10-octyl-8-phenylmethoxy-pyrimido[4,5-b]quinoline-2,4-dione

Systemtic Name: 10-octyl-8-phenylmethoxy-pyrimido[4,5-b]quinoline-2,4-dione Openeye Name: 8-benzyloxy-10-octyl-pyrimido[4,5-b]quinoline-2,4-dione CAS Name: 10-octyl-8-phenylmethoxypyrimido[4,5-b]quinoline-2,4-dione IUPAC Name: 10-octyl-8-phenylmethoxypyrimido[4,5-b]quinoline-2,4-dione Traditional Name: 8-benzoxy-10-octyl-pyrimido[4,5-b]quinoline-2,4-quinone Formula: C26H29N3O3 MolecularWeight: 431.52676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)OCC3=CC=CC=C3)C=C4C1=NC(=O)NC4=O

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)OCC3=CC=CC=C3)C=C4C1=NC(=O)NC4=O

InChI

InChI=1S/C26H29N3O3/c1-2-3-4-5-6-10-15-29-23-17-21(32-18-19-11-8-7-9-12-19)14-13-20(23)16-22-24(29)27-26(31)28-25(22)30/h7-9,11-14,16-17H,2-6,10,15,18H2,1H3,(H,28,30,31)