[2-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]phenyl] ethanoate

Systemtic Name: [2-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]phenyl] ethanoate Openeye Name: [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-prop-2-enoyl]phenyl] acetate CAS Name: acetic acid [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [2-[(E)-2-cyano-3-ethoxy-3-hydroxyprop-2-enoyl]phenyl] acetate Traditional Name: acetic acid [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-acryloyl]phenyl] ester Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=O)C1=CC=CC=C1OC(=O)C)O

Isomeric SMILES

CCO/C(=C(\C#N)/C(=O)C1=CC=CC=C1OC(=O)C)/O

InChI

InChI=1S/C14H13NO5/c1-3-19-14(18)11(8-15)13(17)10-6-4-5-7-12(10)20-9(2)16/h4-7,18H,3H2,1-2H3/b14-11+