(9E,12E)-2-sulfooctadeca-9,12-dienoic acid

Systemtic Name: (9E,12E)-2-sulfooctadeca-9,12-dienoic acid Openeye Name: (9E,12E)-2-sulfooctadeca-9,12-dienoic acid CAS Name: (9E,12E)-2-sulfooctadeca-9,12-dienoic acid IUPAC Name: (9E,12E)-2-sulfooctadeca-9,12-dienoic acid Traditional Name: (9E,12E)-2-sulfooctadeca-9,12-dienoic acid Formula: C18H32O5S MolecularWeight: 360.50868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H32O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18(19)20)24(21,22)23/h6-7,9-10,17H,2-5,8,11-16H2,1H3,(H,19,20)(H,21,22,23)/b7-6+,10-9+