sulfo (E)-octadec-9-enoate

Systemtic Name: sulfo (E)-octadec-9-enoate Openeye Name: sulfo (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid sulfo ester IUPAC Name: sulfo (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid sulfo ester Formula: C18H34O5S MolecularWeight: 362.52456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OS(=O)(=O)O

InChI

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