butyl 7,8-dimethoxy-4-oxidanylidene-1H-pyrimido[4,5-b]quinoline-2-carboxylate

Systemtic Name: butyl 7,8-dimethoxy-4-oxidanylidene-1H-pyrimido[4,5-b]quinoline-2-carboxylate Openeye Name: butyl 7,8-dimethoxy-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxylate CAS Name: 7,8-dimethoxy-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxylic acid butyl ester IUPAC Name: butyl 7,8-dimethoxy-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxylate Traditional Name: 4-keto-7,8-dimethoxy-1H-pyrimido[4,5-b]quinoline-2-carboxylic acid butyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=NC(=O)C2=C(N1)N=C3C=C(C(=CC3=C2)OC)OC

Isomeric SMILES

CCCCOC(=O)C1=NC(=O)C2=C(N1)N=C3C=C(C(=CC3=C2)OC)OC

InChI

InChI=1S/C18H19N3O5/c1-4-5-6-26-18(23)16-20-15-11(17(22)21-16)7-10-8-13(24-2)14(25-3)9-12(10)19-15/h7-9H,4-6H2,1-3H3,(H,19,20,21,22)