1-(2-acetyloxyphenyl)heptane-1-sulfinic acid

Systemtic Name: 1-(2-acetyloxyphenyl)heptane-1-sulfinic acid Openeye Name: 1-(2-acetoxyphenyl)heptane-1-sulfinic acid CAS Name: 1-(2-acetyloxyphenyl)-1-heptanesulfinic acid IUPAC Name: 1-(2-acetyloxyphenyl)heptane-1-sulfinic acid Traditional Name: 1-(2-acetoxyphenyl)heptane-1-sulfinic acid Formula: C15H22O4S MolecularWeight: 298.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1OC(=O)C)S(=O)O

Isomeric SMILES

CCCCCCC(C1=CC=CC=C1OC(=O)C)S(=O)O

InChI

InChI=1S/C15H22O4S/c1-3-4-5-6-11-15(20(17)18)13-9-7-8-10-14(13)19-12(2)16/h7-10,15H,3-6,11H2,1-2H3,(H,17,18)