2-hexylbenzoate

Systemtic Name: 2-hexylbenzoate Openeye Name: 2-hexylbenzoate CAS Name: 2-hexylbenzoate IUPAC Name: 2-hexylbenzoate Traditional Name: 2-hexylbenzoate Formula: C13H17O2- MolecularWeight: 205.27288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCCC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C13H18O2/c1-2-3-4-5-8-11-9-6-7-10-12(11)13(14)15/h6-7,9-10H,2-5,8H2,1H3,(H,14,15)/p-1