(E)-3-(4-pyrimidin-2-ylphenyl)prop-2-enal

Systemtic Name: (E)-3-(4-pyrimidin-2-ylphenyl)prop-2-enal Openeye Name: (E)-3-(4-pyrimidin-2-ylphenyl)prop-2-enal CAS Name: (E)-3-[4-(2-pyrimidinyl)phenyl]-2-propenal IUPAC Name: (E)-3-(4-pyrimidin-2-ylphenyl)prop-2-enal Traditional Name: (E)-3-[4-(2-pyrimidyl)phenyl]acrolein Formula: C13H10N2O MolecularWeight: 210.2313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C2=CC=C(C=C2)C=CC=O

Isomeric SMILES

C1=CN=C(N=C1)C2=CC=C(C=C2)/C=C/C=O

InChI

InChI=1S/C13H10N2O/c16-10-1-3-11-4-6-12(7-5-11)13-14-8-2-9-15-13/h1-10H/b3-1+