sodium 1-methyl-4,6-bis(oxidanylidene)-5-[(E)-pent-2-enyl]-5-propan-2-yl-pyrimidin-2-olate

Systemtic Name: sodium 1-methyl-4,6-bis(oxidanylidene)-5-[(E)-pent-2-enyl]-5-propan-2-yl-pyrimidin-2-olate Openeye Name: sodium 5-isopropyl-1-methyl-4,6-dioxo-5-[(E)-pent-2-enyl]pyrimidin-2-olate CAS Name: sodium 1-methyl-4,6-dioxo-5-[(E)-pent-2-enyl]-5-propan-2-yl-2-pyrimidinolate IUPAC Name: sodium 1-methyl-4,6-dioxo-5-[(E)-pent-2-enyl]-5-propan-2-ylpyrimidin-2-olate Traditional Name: sodium 5-isopropyl-4,6-diketo-1-methyl-5-[(E)-pent-2-enyl]pyrimidin-2-olate Formula: C13H19N2NaO3 MolecularWeight: 274.29133

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC1(C(=O)N=C(N(C1=O)C)[O-])C(C)C.[Na+]

Isomeric SMILES

CC/C=C/CC1(C(=O)N=C(N(C1=O)C)[O-])C(C)C.[Na+]

InChI

InChI=1S/C13H20N2O3.Na/c1-5-6-7-8-13(9(2)3)10(16)14-12(18)15(4)11(13)17;/h6-7,9H,5,8H2,1-4H3,(H,14,16,18);/q;+1/p-1/b7-6+;