bis[(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] (E)-but-2-enedioate

Systemtic Name: bis[(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] (E)-but-2-enedioate Openeye Name: bis[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid bis[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] ester IUPAC Name: bis[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis[(4-keto-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] ester Formula: C24H22N4O6+2 MolecularWeight: 462.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=CC2=O)COC(=O)C=CC(=O)OCC3=CC(=O)[N+]4=C(C=CC=C4N3)C

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=CC2=O)COC(=O)/C=C/C(=O)OCC3=CC(=O)[N+]4=C(C=CC=C4N3)C

InChI

InChI=1S/C24H20N4O6/c1-15-5-3-7-19-25-17(11-21(29)27(15)19)13-33-23(31)9-10-24(32)34-14-18-12-22(30)28-16(2)6-4-8-20(28)26-18/h3-12H,13-14H2,1-2H3/p+2/b10-9+