(2-nonanoylphenyl) hydrogen sulfite

Systemtic Name: (2-nonanoylphenyl) hydrogen sulfite Openeye Name: (2-nonanoylphenyl) hydrogen sulfite CAS Name: sulfurous acid [2-(1-oxononyl)phenyl] ester IUPAC Name: (2-nonanoylphenyl) hydrogen sulfite Traditional Name: sulfurous acid (2-pelargonylphenyl) ester Formula: C15H22O4S MolecularWeight: 298.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1=CC=CC=C1OS(=O)O

Isomeric SMILES

CCCCCCCCC(=O)C1=CC=CC=C1OS(=O)O

InChI

InChI=1S/C15H22O4S/c1-2-3-4-5-6-7-11-14(16)13-10-8-9-12-15(13)19-20(17)18/h8-10,12H,2-7,11H2,1H3,(H,17,18)