[10-octyl-2,4-bis(oxidanylidene)pyrimido[4,5-b]quinolin-8-yl] ethanoate

Systemtic Name: [10-octyl-2,4-bis(oxidanylidene)pyrimido[4,5-b]quinolin-8-yl] ethanoate Openeye Name: (10-octyl-2,4-dioxo-pyrimido[4,5-b]quinolin-8-yl) acetate CAS Name: acetic acid (10-octyl-2,4-dioxo-8-pyrimido[4,5-b]quinolinyl) ester IUPAC Name: (10-octyl-2,4-dioxopyrimido[4,5-b]quinolin-8-yl) acetate Traditional Name: acetic acid (2,4-diketo-10-octyl-pyrimido[4,5-b]quinolin-8-yl) ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)OC(=O)C)C=C3C1=NC(=O)NC3=O

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)OC(=O)C)C=C3C1=NC(=O)NC3=O

InChI

InChI=1S/C21H25N3O4/c1-3-4-5-6-7-8-11-24-18-13-16(28-14(2)25)10-9-15(18)12-17-19(24)22-21(27)23-20(17)26/h9-10,12-13H,3-8,11H2,1-2H3,(H,23,26,27)