dimethyl (E)-2-(2-methyl-6-oxidanylidene-pyridin-1-yl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(2-methyl-6-oxidanylidene-pyridin-1-yl)but-2-enedioate Openeye Name: dimethyl (E)-2-(2-methyl-6-oxo-1-pyridyl)but-2-enedioate CAS Name: (E)-2-(2-methyl-6-oxo-1-pyridinyl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(2-methyl-6-oxopyridin-1-yl)but-2-enedioate Traditional Name: (E)-2-(2-keto-6-methyl-1-pyridyl)but-2-enedioic acid dimethyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=O)N1C(=CC(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=O)N1/C(=C/C(=O)OC)/C(=O)OC

InChI

InChI=1S/C12H13NO5/c1-8-5-4-6-10(14)13(8)9(12(16)18-3)7-11(15)17-2/h4-7H,1-3H3/b9-7+