(9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid

Systemtic Name: (9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid Openeye Name: (9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid CAS Name: (9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid IUPAC Name: (9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid Traditional Name: (9E,12E,15E)-2-sulfooctadeca-9,12,15-trienoic acid Formula: C18H30O5S MolecularWeight: 358.4928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18(19)20)24(21,22)23/h3-4,6-7,9-10,17H,2,5,8,11-16H2,1H3,(H,19,20)(H,21,22,23)/b4-3+,7-6+,10-9+