methyl 3-[3-[(E)-5-oxidanylidenepent-3-enyl]oxiran-2-yl]benzoate

Systemtic Name: methyl 3-[3-[(E)-5-oxidanylidenepent-3-enyl]oxiran-2-yl]benzoate Openeye Name: methyl 3-[3-[(E)-5-oxopent-3-enyl]oxiran-2-yl]benzoate CAS Name: 3-[3-[(E)-5-oxopent-3-enyl]-2-oxiranyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-[(E)-5-oxopent-3-enyl]oxiran-2-yl]benzoate Traditional Name: 3-[3-[(E)-5-ketopent-3-enyl]oxiran-2-yl]benzoic acid methyl ester Formula: C15H16O4 MolecularWeight: 260.28514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C2C(O2)CCC=CC=O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C2C(O2)CC/C=C/C=O

InChI

InChI=1S/C15H16O4/c1-18-15(17)12-7-5-6-11(10-12)14-13(19-14)8-3-2-4-9-16/h2,4-7,9-10,13-14H,3,8H2,1H3/b4-2+