O1-ethyl O4-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl] ester IUPAC Name: 1-O-ethyl 4-O-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl] ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC1=CC(=O)N2C=CC=C(C2=N1)C

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC1=CC(=O)N2C=CC=C(C2=N1)C

InChI

InChI=1S/C16H16N2O5/c1-3-22-14(20)6-7-15(21)23-10-12-9-13(19)18-8-4-5-11(2)16(18)17-12/h4-9H,3,10H2,1-2H3/b7-6+