sodium (E)-18-sulfooctadec-9-enoate

Systemtic Name: sodium (E)-18-sulfooctadec-9-enoate Openeye Name: sodium (E)-18-sulfooctadec-9-enoate CAS Name: sodium (E)-18-sulfo-9-octadecenoate IUPAC Name: sodium (E)-18-sulfooctadec-9-enoate Traditional Name: sodium (E)-18-sulfooctadec-9-enoate Formula: C18H33NaO5S MolecularWeight: 384.50639

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCS(=O)(=O)O)CCCC=CCCCCCCCC(=O)[O-].[Na+]

Isomeric SMILES

C(CCCCS(=O)(=O)O)CCC/C=C/CCCCCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C18H34O5S.Na/c19-18(20)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-24(21,22)23;/h1-2H,3-17H2,(H,19,20)(H,21,22,23);/q;+1/p-1/b2-1+;