pentan-3-yl benzoate

Systemtic Name: pentan-3-yl benzoate Openeye Name: 1-ethylpropyl benzoate CAS Name: benzoic acid pentan-3-yl ester IUPAC Name: pentan-3-yl benzoate Traditional Name: benzoic acid 1-ethylpropyl ester Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(CC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H16O2/c1-3-11(4-2)14-12(13)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3