sodium 2-[[(E)-octadec-9-enoyl]amino]ethanesulfonate

Systemtic Name: sodium 2-[[(E)-octadec-9-enoyl]amino]ethanesulfonate Openeye Name: sodium 2-[[(E)-octadec-9-enoyl]amino]ethanesulfonate CAS Name: sodium 2-[[(E)-1-oxooctadec-9-enyl]amino]ethanesulfonate IUPAC Name: sodium 2-[[(E)-octadec-9-enoyl]amino]ethanesulfonate Traditional Name: sodium 2-[[(E)-octadec-9-enoyl]amino]ethanesulfonate Formula: C20H38NNaO4S MolecularWeight: 411.57479

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C20H39NO4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)21-18-19-26(23,24)25;/h9-10H,2-8,11-19H2,1H3,(H,21,22)(H,23,24,25);/q;+1/p-1/b10-9+;