(E)-3-(1-phenylpyrazol-4-yl)prop-2-enal

Systemtic Name: (E)-3-(1-phenylpyrazol-4-yl)prop-2-enal Openeye Name: (E)-3-(1-phenylpyrazol-4-yl)prop-2-enal CAS Name: (E)-3-(1-phenyl-4-pyrazolyl)-2-propenal IUPAC Name: (E)-3-(1-phenylpyrazol-4-yl)prop-2-enal Traditional Name: (E)-3-(1-phenylpyrazol-4-yl)acrolein Formula: C12H10N2O MolecularWeight: 198.2206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C=O

InChI

InChI=1S/C12H10N2O/c15-8-4-5-11-9-13-14(10-11)12-6-2-1-3-7-12/h1-10H/b5-4+