(E)-3-[2-(furan-2-ylmethylamino)pyrimidin-5-yl]prop-2-enoate

Systemtic Name: (E)-3-[2-(furan-2-ylmethylamino)pyrimidin-5-yl]prop-2-enoate Openeye Name: (E)-3-[2-(2-furylmethylamino)pyrimidin-5-yl]prop-2-enoate CAS Name: (E)-3-[2-(2-furanylmethylamino)-5-pyrimidinyl]-2-propenoate IUPAC Name: (E)-3-[2-(furan-2-ylmethylamino)pyrimidin-5-yl]prop-2-enoate Traditional Name: (E)-3-[2-(2-furfurylamino)pyrimidin-5-yl]acrylate Formula: C12H10N3O3- MolecularWeight: 244.2261

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NC=C(C=N2)C=CC(=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC2=NC=C(C=N2)/C=C/C(=O)[O-]

InChI

InChI=1S/C12H11N3O3/c16-11(17)4-3-9-6-13-12(14-7-9)15-8-10-2-1-5-18-10/h1-7H,8H2,(H,16,17)(H,13,14,15)/p-1/b4-3+