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2-(5-butylhexadecan-5-yl)benzenesulfonate

2-(5-butylhexadecan-5-yl)benzenesulfonate

Systemtic Name:2-(5-butylhexadecan-5-yl)benzenesulfonate
Openeye Name:2-(1,1-dibutyldodecyl)benzenesulfonate
CAS Name:2-(5-butylhexadecan-5-yl)benzenesulfonate
IUPAC Name:2-(5-butylhexadecan-5-yl)benzenesulfonate
Traditional Name:2-(1,1-dibutyldodecyl)besylate
Formula: C26H45O3S-
MolecularWeight: 437.6987
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCC)(CCCC)C1=CC=CC=C1S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCC(CCCC)(CCCC)C1=CC=CC=C1S(=O)(=O)[O-]


InChI

InChI=1S/C26H46O3S/c1-4-7-10-11-12-13-14-15-18-23-26(21-8-5-2,22-9-6-3)24-19-16-17-20-25(24)30(27,28)29/h16-17,19-20H,4-15,18,21-23H2,1-3H3,(H,27,28,29)/p-1


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