4-octylbenzoate

Systemtic Name: 4-octylbenzoate Openeye Name: 4-octylbenzoate CAS Name: 4-octylbenzoate IUPAC Name: 4-octylbenzoate Traditional Name: 4-octylbenzoate Formula: C15H21O2- MolecularWeight: 233.32604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C15H22O2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h9-12H,2-8H2,1H3,(H,16,17)/p-1