(2-pentylphenyl) hydrogen sulfate

Systemtic Name: (2-pentylphenyl) hydrogen sulfate Openeye Name: (2-pentylphenyl) hydrogen sulfate CAS Name: sulfuric acid (2-pentylphenyl) ester IUPAC Name: (2-pentylphenyl) hydrogen sulfate Traditional Name: sulfuric acid (2-amylphenyl) ester Formula: C11H16O4S MolecularWeight: 244.30734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1OS(=O)(=O)O

Isomeric SMILES

CCCCCC1=CC=CC=C1OS(=O)(=O)O

InChI

InChI=1S/C11H16O4S/c1-2-3-4-7-10-8-5-6-9-11(10)15-16(12,13)14/h5-6,8-9H,2-4,7H2,1H3,(H,12,13,14)