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

Systemtic Name: (E)-3-[2-(3-cyanopropoxy)-3-ethoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(3-cyanopropoxy)-3-ethoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(3-cyanopropoxy)-3-ethoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(3-cyanopropoxy)-3-ethoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(3-cyanopropoxy)-3-ethoxy-phenyl]acrylic acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCCCC#N)C=CC(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1OCCCC#N)/C=C/C(=O)O

InChI

InChI=1S/C15H17NO4/c1-2-19-13-7-5-6-12(8-9-14(17)18)15(13)20-11-4-3-10-16/h5-9H,2-4,11H2,1H3,(H,17,18)/b9-8+