(E)-4-(2-methylpyrimidin-5-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2-methylpyrimidin-5-yl)but-3-en-2-one Openeye Name: (E)-4-(2-methylpyrimidin-5-yl)but-3-en-2-one CAS Name: (E)-4-(2-methyl-5-pyrimidinyl)-3-buten-2-one IUPAC Name: (E)-4-(2-methylpyrimidin-5-yl)but-3-en-2-one Traditional Name: (E)-4-(2-methylpyrimidin-5-yl)but-3-en-2-one Formula: C9H10N2O MolecularWeight: 162.1885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C=CC(=O)C

Isomeric SMILES

CC1=NC=C(C=N1)/C=C/C(=O)C

InChI

InChI=1S/C9H10N2O/c1-7(12)3-4-9-5-10-8(2)11-6-9/h3-6H,1-2H3/b4-3+