[2-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]-6-methyl-phenyl] ethanoate

Systemtic Name: [2-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]-6-methyl-phenyl] ethanoate Openeye Name: [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-prop-2-enoyl]-6-methyl-phenyl] acetate CAS Name: acetic acid [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-1-oxoprop-2-enyl]-6-methylphenyl] ester IUPAC Name: [2-[(E)-2-cyano-3-ethoxy-3-hydroxyprop-2-enoyl]-6-methylphenyl] acetate Traditional Name: acetic acid [2-[(E)-2-cyano-3-ethoxy-3-hydroxy-acryloyl]-6-methyl-phenyl] ester Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO5/c1-4-20-15(19)12(8-16)13(18)11-7-5-6-9(2)14(11)21-10(3)17/h5-7,19H,4H2,1-3H3/b15-12+