sodium 3-[(E)-tetradec-9-enoyl]oxypropane-1-sulfonate

Systemtic Name: sodium 3-[(E)-tetradec-9-enoyl]oxypropane-1-sulfonate Openeye Name: sodium 3-[(E)-tetradec-9-enoyl]oxypropane-1-sulfonate CAS Name: sodium 3-[(E)-1-oxotetradec-9-enoxy]-1-propanesulfonate IUPAC Name: sodium 3-[(E)-tetradec-9-enoyl]oxypropane-1-sulfonate Traditional Name: sodium 3-[(E)-tetradec-9-enoyl]oxypropane-1-sulfonate Formula: C17H31NaO5S MolecularWeight: 370.47981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCCCCCCC(=O)OCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C17H32O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-14-17(18)22-15-13-16-23(19,20)21;/h5-6H,2-4,7-16H2,1H3,(H,19,20,21);/q;+1/p-1/b6-5+;