(E)-2-(2-sulfoethyl)octadec-9-enoic acid

Systemtic Name: (E)-2-(2-sulfoethyl)octadec-9-enoic acid Openeye Name: (E)-2-(2-sulfoethyl)octadec-9-enoic acid CAS Name: (E)-2-(2-sulfoethyl)-9-octadecenoic acid IUPAC Name: (E)-2-(2-sulfoethyl)octadec-9-enoic acid Traditional Name: (E)-2-(2-sulfoethyl)octadec-9-enoic acid Formula: C20H38O5S MolecularWeight: 390.57772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(CCS(=O)(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(CCS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C20H38O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(20(21)22)17-18-26(23,24)25/h9-10,19H,2-8,11-18H2,1H3,(H,21,22)(H,23,24,25)/b10-9+