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

Systemtic Name: (E)-3-[2-(2-methylpropylamino)pyrimidin-5-yl]prop-2-enoate Openeye Name: (E)-3-[2-(isobutylamino)pyrimidin-5-yl]prop-2-enoate CAS Name: (E)-3-[2-(2-methylpropylamino)-5-pyrimidinyl]-2-propenoate IUPAC Name: (E)-3-[2-(2-methylpropylamino)pyrimidin-5-yl]prop-2-enoate Traditional Name: (E)-3-[2-(isobutylamino)pyrimidin-5-yl]acrylate Formula: C11H14N3O2- MolecularWeight: 220.24776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC=C(C=N1)C=CC(=O)[O-]

Isomeric SMILES

CC(C)CNC1=NC=C(C=N1)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H15N3O2/c1-8(2)5-12-11-13-6-9(7-14-11)3-4-10(15)16/h3-4,6-8H,5H2,1-2H3,(H,15,16)(H,12,13,14)/p-1/b4-3+