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2,3-bis(2-butyloctyl)benzenesulfonic acid

2,3-bis(2-butyloctyl)benzenesulfonic acid

Systemtic Name:2,3-bis(2-butyloctyl)benzenesulfonic acid
Openeye Name:2,3-bis(2-butyloctyl)benzenesulfonic acid
CAS Name:2,3-bis(2-butyloctyl)benzenesulfonic acid
IUPAC Name:2,3-bis(2-butyloctyl)benzenesulfonic acid
Traditional Name:2,3-bis(2-butyloctyl)besylic acid
Formula: C30H54O3S
MolecularWeight: 494.81296
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)CC1=C(C(=CC=C1)S(=O)(=O)O)CC(CCCC)CCCCCC


Isomeric SMILES

CCCCCCC(CCCC)CC1=C(C(=CC=C1)S(=O)(=O)O)CC(CCCC)CCCCCC


InChI

InChI=1S/C30H54O3S/c1-5-9-13-15-20-26(18-11-7-3)24-28-22-17-23-30(34(31,32)33)29(28)25-27(19-12-8-4)21-16-14-10-6-2/h17,22-23,26-27H,5-16,18-21,24-25H2,1-4H3,(H,31,32,33)


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