(9E,12E)-octadeca-9,12-diene-1-sulfonic acid

Systemtic Name: (9E,12E)-octadeca-9,12-diene-1-sulfonic acid Openeye Name: (9E,12E)-octadeca-9,12-diene-1-sulfonic acid CAS Name: (9E,12E)-1-octadeca-9,12-dienesulfonic acid IUPAC Name: (9E,12E)-octadeca-9,12-diene-1-sulfonic acid Traditional Name: (9E,12E)-octadeca-9,12-diene-1-sulfonic acid Formula: C18H34O3S MolecularWeight: 330.52576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCS(=O)(=O)O

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCS(=O)(=O)O

InChI

InChI=1S/C18H34O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(19,20)21/h6-7,9-10H,2-5,8,11-18H2,1H3,(H,19,20,21)/b7-6+,10-9+