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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C=N1)C=CC(=O)[O-]

Isomeric SMILES

CCCCNC1=NC=C(C=N1)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H15N3O2/c1-2-3-6-12-11-13-7-9(8-14-11)4-5-10(15)16/h4-5,7-8H,2-3,6H2,1H3,(H,15,16)(H,12,13,14)/p-1/b5-4+