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4-dodecan-2-ylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol

4-dodecan-2-ylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol

Systemtic Name:4-dodecan-2-ylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
Openeye Name:2-(2-hydroxyethylamino)ethanol; 4-(1-methylundecyl)benzenesulfonic acid
CAS Name:4-dodecan-2-ylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
IUPAC Name:4-dodecan-2-ylbenzenesulfonic acid; 2-(2-hydroxyethylamino)ethanol
Traditional Name:2-(2-hydroxyethylamino)ethanol; 4-(1-methylundecyl)besylic acid
Formula: C22H41NO5S
MolecularWeight: 431.62964
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)C1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO


Isomeric SMILES

CCCCCCCCCCC(C)C1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO


InChI

InChI=1S/C18H30O3S.C4H11NO2/c1-3-4-5-6-7-8-9-10-11-16(2)17-12-14-18(15-13-17)22(19,20)21;6-3-1-5-2-4-7/h12-16H,3-11H2,1-2H3,(H,19,20,21);5-7H,1-4H2


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