[2-(hydroxymethyl)-6-methyl-heptyl] hydrogen sulfite

Systemtic Name: [2-(hydroxymethyl)-6-methyl-heptyl] hydrogen sulfite Openeye Name: [2-(hydroxymethyl)-6-methyl-heptyl] hydrogen sulfite CAS Name: sulfurous acid [2-(hydroxymethyl)-6-methylheptyl] ester IUPAC Name: [2-(hydroxymethyl)-6-methylheptyl] hydrogen sulfite Traditional Name: sulfurous acid (6-methyl-2-methylol-heptyl) ester Formula: C9H20O4S MolecularWeight: 224.3177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(CO)COS(=O)O

Isomeric SMILES

CC(C)CCCC(CO)COS(=O)O

InChI

InChI=1S/C9H20O4S/c1-8(2)4-3-5-9(6-10)7-13-14(11)12/h8-10H,3-7H2,1-2H3,(H,11,12)