methyl 4-[(E)-3-oxidanylidenepent-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-oxidanylidenepent-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-oxopent-1-enyl]benzoate CAS Name: 4-[(E)-3-oxopent-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxopent-1-enyl]benzoate Traditional Name: 4-[(E)-3-ketopent-1-enyl]benzoic acid methyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C=CC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C13H14O3/c1-3-12(14)9-6-10-4-7-11(8-5-10)13(15)16-2/h4-9H,3H2,1-2H3/b9-6+