2,3-dibutylnaphthalene-1-sulfonic acid; 2-(2-hydroxyethylamino)ethanol

Systemtic Name: 2,3-dibutylnaphthalene-1-sulfonic acid; 2-(2-hydroxyethylamino)ethanol Openeye Name: 2,3-dibutylnaphthalene-1-sulfonic acid; 2-(2-hydroxyethylamino)ethanol CAS Name: 2,3-dibutyl-1-naphthalenesulfonic acid; 2-(2-hydroxyethylamino)ethanol IUPAC Name: 2,3-dibutylnaphthalene-1-sulfonic acid; 2-(2-hydroxyethylamino)ethanol Traditional Name: 2,3-dibutylnaphthalene-1-sulfonic acid; 2-(2-hydroxyethylamino)ethanol Formula: C22H35NO5S MolecularWeight: 425.582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O.C(CO)NCCO

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O.C(CO)NCCO

InChI

InChI=1S/C18H24O3S.C4H11NO2/c1-3-5-9-14-13-15-10-7-8-12-17(15)18(22(19,20)21)16(14)11-6-4-2;6-3-1-5-2-4-7/h7-8,10,12-13H,3-6,9,11H2,1-2H3,(H,19,20,21);5-7H,1-4H2