diethyl (E)-2-[5-methyl-2,4-bis(oxidanylidene)-3-prop-1-ynyl-pyrimidin-1-yl]but-2-enedioate

Systemtic Name: diethyl (E)-2-[5-methyl-2,4-bis(oxidanylidene)-3-prop-1-ynyl-pyrimidin-1-yl]but-2-enedioate Openeye Name: diethyl (E)-2-(5-methyl-2,4-dioxo-3-prop-1-ynyl-pyrimidin-1-yl)but-2-enedioate CAS Name: (E)-2-(5-methyl-2,4-dioxo-3-prop-1-ynyl-1-pyrimidinyl)-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-(5-methyl-2,4-dioxo-3-prop-1-ynylpyrimidin-1-yl)but-2-enedioate Traditional Name: (E)-2-(2,4-diketo-5-methyl-3-prop-1-ynyl-pyrimidin-1-yl)but-2-enedioic acid diethyl ester Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(=O)OCC)N1C=C(C(=O)N(C1=O)C#CC)C

Isomeric SMILES

CCOC(=O)/C=C(\C(=O)OCC)/N1C=C(C(=O)N(C1=O)C#CC)C

InChI

InChI=1S/C16H18N2O6/c1-5-8-17-14(20)11(4)10-18(16(17)22)12(15(21)24-7-3)9-13(19)23-6-2/h9-10H,6-7H2,1-4H3/b12-9+