ethyl 3-[(E)-4-oxidanylidenebut-1-enyl]benzoate

Systemtic Name: ethyl 3-[(E)-4-oxidanylidenebut-1-enyl]benzoate Openeye Name: ethyl 3-[(E)-4-oxobut-1-enyl]benzoate CAS Name: 3-[(E)-4-oxobut-1-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-4-oxobut-1-enyl]benzoate Traditional Name: 3-[(E)-4-ketobut-1-enyl]benzoic acid ethyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C=CCC=O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)/C=C/CC=O

InChI

InChI=1S/C13H14O3/c1-2-16-13(15)12-8-5-7-11(10-12)6-3-4-9-14/h3,5-10H,2,4H2,1H3/b6-3+