sodium bis[(Z)-octadec-9-enyl] sulfate

Systemtic Name: sodium bis[(Z)-octadec-9-enyl] sulfate Openeye Name: sodium bis[(Z)-octadec-9-enyl] sulfate CAS Name: sodium sulfuric acid bis[(Z)-octadec-9-enyl] ester IUPAC Name: sodium bis[(Z)-octadec-9-enyl] sulfate Traditional Name: sodium sulfuric acid bis[(Z)-octadec-9-enyl] ester Formula: C36H70NaO4S+ MolecularWeight: 621.99337

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOS(=O)(=O)OCCCCCCCCC=CCCCCCCCC.[Na+]

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)OCCCCCCCC/C=C\CCCCCCCC.[Na+]

InChI

InChI=1S/C36H70O4S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-41(37,38)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h17-20H,3-16,21-36H2,1-2H3;/q;+1/b19-17-,20-18-;