O4-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl] ester O1-methyl ester Formula: C18H13BrN2O5 MolecularWeight: 417.21022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C18H13BrN2O5/c1-25-17(23)11-2-4-12(5-3-11)18(24)26-10-14-8-16(22)21-9-13(19)6-7-15(21)20-14/h2-9H,10H2,1H3