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3,4,5-tridodecyl-2-propan-2-yl-benzenesulfinate

3,4,5-tridodecyl-2-propan-2-yl-benzenesulfinate

Systemtic Name:3,4,5-tridodecyl-2-propan-2-yl-benzenesulfinate
Openeye Name:3,4,5-tridodecyl-2-isopropyl-benzenesulfinate
CAS Name:3,4,5-tridodecyl-2-propan-2-ylbenzenesulfinate
IUPAC Name:3,4,5-tridodecyl-2-propan-2-ylbenzenesulfinate
Traditional Name:2-isopropyl-3,4,5-trilauryl-benzenesulfinate
Formula: C45H83O2S-
MolecularWeight: 688.20432
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(C(=C1CCCCCCCCCCCC)CCCCCCCCCCCC)C(C)C)S(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(C(=C1CCCCCCCCCCCC)CCCCCCCCCCCC)C(C)C)S(=O)[O-]


InChI

InChI=1S/C45H84O2S/c1-6-9-12-15-18-21-24-27-30-33-36-41-39-44(48(46)47)45(40(4)5)43(38-35-32-29-26-23-20-17-14-11-8-3)42(41)37-34-31-28-25-22-19-16-13-10-7-2/h39-40H,6-38H2,1-5H3,(H,46,47)/p-1


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