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

Systemtic Name: (E)-3-[3-(3-cyanopropoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-(3-cyanopropoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-(3-cyanopropoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-(3-cyanopropoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-(3-cyanopropoxy)phenyl]acrylic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c14-8-1-2-9-17-12-5-3-4-11(10-12)6-7-13(15)16/h3-7,10H,1-2,9H2,(H,15,16)/b7-6+