cyclohexanol; (E)-4-oxidanylidene-4-(2H-pyrimidin-1-yloxy)but-2-enoate

Systemtic Name: cyclohexanol; (E)-4-oxidanylidene-4-(2H-pyrimidin-1-yloxy)but-2-enoate Openeye Name: cyclohexanol; (E)-4-oxo-4-(2H-pyrimidin-1-yloxy)but-2-enoate CAS Name: cyclohexanol; (E)-4-oxo-4-(2H-pyrimidin-1-yloxy)-2-butenoate IUPAC Name: cyclohexanol; (E)-4-oxo-4-(2H-pyrimidin-1-yloxy)but-2-enoate Traditional Name: cyclohexanol; (E)-4-keto-4-(2H-pyrimidin-1-yloxy)but-2-enoate Formula: C14H19N2O5- MolecularWeight: 295.31106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)O.C1N=CC=CN1OC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)O.C1N=CC=CN1OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C8H8N2O4.C6H12O/c11-7(12)2-3-8(13)14-10-5-1-4-9-6-10;7-6-4-2-1-3-5-6/h1-5H,6H2,(H,11,12);6-7H,1-5H2/p-1/b3-2+;