(E)-3-[2-(3-cyanopropoxy)-4-propoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(3-cyanopropoxy)-4-propoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(3-cyanopropoxy)-4-propoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(3-cyanopropoxy)-4-propoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(3-cyanopropoxy)-4-propoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(3-cyanopropoxy)-4-propoxy-phenyl]acrylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C=CC(=O)O)OCCCC#N

Isomeric SMILES

CCCOC1=CC(=C(C=C1)/C=C/C(=O)O)OCCCC#N

InChI

InChI=1S/C16H19NO4/c1-2-10-20-14-7-5-13(6-8-16(18)19)15(12-14)21-11-4-3-9-17/h5-8,12H,2-4,10-11H2,1H3,(H,18,19)/b8-6+