sodium [(E)-octadec-9-enoyl] sulfate sulfate

Systemtic Name: sodium [(E)-octadec-9-enoyl] sulfate sulfate Openeye Name: sodium [(E)-octadec-9-enoyl] sulfate sulfate CAS Name: sodium [(E)-1-oxooctadec-9-enyl] sulfate sulfate IUPAC Name: sodium [(E)-octadec-9-enoyl] sulfate sulfate Traditional Name: sodium [(E)-octadec-9-enoyl] sulfate sulfate Formula: C18H33NaO9S2-2 MolecularWeight: 480.56899

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OS(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OS(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C18H34O5S.Na.H2O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)23-24(20,21)22;;1-5(2,3)4/h9-10H,2-8,11-17H2,1H3,(H,20,21,22);;(H2,1,2,3,4)/q;+1;/p-3/b10-9+;;