4-pentylbenzoate

Systemtic Name: 4-pentylbenzoate Openeye Name: 4-pentylbenzoate CAS Name: 4-pentylbenzoate IUPAC Name: 4-pentylbenzoate Traditional Name: 4-amylbenzoate Formula: C12H15O2- MolecularWeight: 191.2463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C12H16O2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h6-9H,2-5H2,1H3,(H,13,14)/p-1