methyl 3-[(E)-5-oxidanylpent-1-enyl]benzoate

Systemtic Name: methyl 3-[(E)-5-oxidanylpent-1-enyl]benzoate Openeye Name: methyl 3-[(E)-5-hydroxypent-1-enyl]benzoate CAS Name: 3-[(E)-5-hydroxypent-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(E)-5-hydroxypent-1-enyl]benzoate Traditional Name: 3-[(E)-5-hydroxypent-1-enyl]benzoic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C=CCCCO

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)/C=C/CCCO

InChI

InChI=1S/C13H16O3/c1-16-13(15)12-8-5-7-11(10-12)6-3-2-4-9-14/h3,5-8,10,14H,2,4,9H2,1H3/b6-3+