(2E,4E)-hepta-2,4,6-trienoic acid; prop-2-enenitrile

Systemtic Name: (2E,4E)-hepta-2,4,6-trienoic acid; prop-2-enenitrile Openeye Name: (2E,4E)-hepta-2,4,6-trienoic acid; prop-2-enenitrile CAS Name: (2E,4E)-hepta-2,4,6-trienoic acid; 2-propenenitrile IUPAC Name: (2E,4E)-hepta-2,4,6-trienoic acid; prop-2-enenitrile Traditional Name: acrylonitrile; (2E,4E)-hepta-2,4,6-trienoic acid Formula: C10H11NO2 MolecularWeight: 177.19984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC=CC(=O)O.C=CC#N

Isomeric SMILES

C=C/C=C/C=C/C(=O)O.C=CC#N

InChI

InChI=1S/C7H8O2.C3H3N/c1-2-3-4-5-6-7(8)9;1-2-3-4/h2-6H,1H2,(H,8,9);2H,1H2/b4-3+,6-5+;