cyanomethyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name: cyanomethyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Openeye Name: cyanomethyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid cyanomethyl ester IUPAC Name: cyanomethyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]acrylic acid cyanomethyl ester Formula: C13H10N2O3 MolecularWeight: 242.2301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)OCC#N)OCC#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)OCC#N)OCC#N

InChI

InChI=1S/C13H10N2O3/c14-7-9-17-12-4-1-11(2-5-12)3-6-13(16)18-10-8-15/h1-6H,9-10H2/b6-3+