(E)-3-cyclopropyl-2-(phenylcarbonyl)but-2-enenitrile

Systemtic Name: (E)-3-cyclopropyl-2-(phenylcarbonyl)but-2-enenitrile Openeye Name: (E)-2-benzoyl-3-cyclopropyl-but-2-enenitrile CAS Name: (E)-2-benzoyl-3-cyclopropyl-2-butenenitrile IUPAC Name: (E)-2-benzoyl-3-cyclopropylbut-2-enenitrile Traditional Name: (E)-2-benzoyl-3-cyclopropyl-but-2-enenitrile Formula: C14H13NO MolecularWeight: 211.25912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)C1=CC=CC=C1)C2CC2

Isomeric SMILES

C/C(=C(/C#N)\C(=O)C1=CC=CC=C1)/C2CC2

InChI

InChI=1S/C14H13NO/c1-10(11-7-8-11)13(9-15)14(16)12-5-3-2-4-6-12/h2-6,11H,7-8H2,1H3/b13-10+