4-[(E)-octadec-1-enyl]-2,5-bis(oxidanyl)benzenesulfonate

Systemtic Name: 4-[(E)-octadec-1-enyl]-2,5-bis(oxidanyl)benzenesulfonate Openeye Name: 2,5-dihydroxy-4-[(E)-octadec-1-enyl]benzenesulfonate CAS Name: 2,5-dihydroxy-4-[(E)-octadec-1-enyl]benzenesulfonate IUPAC Name: 2,5-dihydroxy-4-[(E)-octadec-1-enyl]benzenesulfonate Traditional Name: 2,5-dihydroxy-4-[(E)-octadec-1-enyl]besylate Formula: C24H39O5S- MolecularWeight: 439.62846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CC1=CC(=C(C=C1O)S(=O)(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/C1=CC(=C(C=C1O)S(=O)(=O)[O-])O

InChI

InChI=1S/C24H40O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-23(26)24(20-22(21)25)30(27,28)29/h17-20,25-26H,2-16H2,1H3,(H,27,28,29)/p-1/b18-17+