3-[(E)-hex-1-enyl]-2-(hydroxymethyl)benzoate

Systemtic Name: 3-[(E)-hex-1-enyl]-2-(hydroxymethyl)benzoate Openeye Name: 3-[(E)-hex-1-enyl]-2-(hydroxymethyl)benzoate CAS Name: 3-[(E)-hex-1-enyl]-2-(hydroxymethyl)benzoate IUPAC Name: 3-[(E)-hex-1-enyl]-2-(hydroxymethyl)benzoate Traditional Name: 3-[(E)-hex-1-enyl]-2-methylol-benzoate Formula: C14H17O3- MolecularWeight: 233.28298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1=C(C(=CC=C1)C(=O)[O-])CO

Isomeric SMILES

CCCC/C=C/C1=C(C(=CC=C1)C(=O)[O-])CO

InChI

InChI=1S/C14H18O3/c1-2-3-4-5-7-11-8-6-9-12(14(16)17)13(11)10-15/h5-9,15H,2-4,10H2,1H3,(H,16,17)/p-1/b7-5+