3-hexoxybenzoate

Systemtic Name: 3-hexoxybenzoate Openeye Name: 3-hexoxybenzoate CAS Name: 3-hexoxybenzoate IUPAC Name: 3-hexoxybenzoate Traditional Name: 3-hexoxybenzoate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C13H18O3/c1-2-3-4-5-9-16-12-8-6-7-11(10-12)13(14)15/h6-8,10H,2-5,9H2,1H3,(H,14,15)/p-1