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lithium triacontyl benzenesulfonate

lithium triacontyl benzenesulfonate

Systemtic Name:lithium triacontyl benzenesulfonate
Openeye Name:lithium triacontyl benzenesulfonate
CAS Name:lithium benzenesulfonic acid triacontyl ester
IUPAC Name:lithium triacontyl benzenesulfonate
Traditional Name:lithium benzenesulfonic acid melissyl ester
Formula: C36H66LiO3S+
MolecularWeight: 585.91344
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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1


Isomeric SMILES

[Li+].CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1


InChI

InChI=1S/C36H66O3S.Li/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-32-35-39-40(37,38)36-33-30-29-31-34-36;/h29-31,33-34H,2-28,32,35H2,1H3;/q;+1


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