1-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid

Systemtic Name: 1-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid Openeye Name: 1-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid CAS Name: 1-[[(E)-1-oxooctadec-9-enyl]amino]ethanesulfonic acid IUPAC Name: 1-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid Traditional Name: 1-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid Formula: C20H39NO4S MolecularWeight: 389.59296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(C)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(C)S(=O)(=O)O

InChI

InChI=1S/C20H39NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22)21-19(2)26(23,24)25/h10-11,19H,3-9,12-18H2,1-2H3,(H,21,22)(H,23,24,25)/b11-10+