2-azanylethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonyl-benzenesulfonic acid

Systemtic Name: 2-azanylethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonyl-benzenesulfonic acid Openeye Name: 2-aminoethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonyl-benzenesulfonic acid CAS Name: 2-aminoethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonylbenzenesulfonic acid IUPAC Name: 2-aminoethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonylbenzenesulfonic acid Traditional Name: 2-aminoethanol; 2-[2-(2-cyanoethoxy)ethoxy]-5-nonyl-besylic acid Formula: C22H38N2O6S MolecularWeight: 458.61192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(C=C1)OCCOCCC#N)S(=O)(=O)O.C(CO)N

Isomeric SMILES

CCCCCCCCCC1=CC(=C(C=C1)OCCOCCC#N)S(=O)(=O)O.C(CO)N

InChI

InChI=1S/C20H31NO5S.C2H7NO/c1-2-3-4-5-6-7-8-10-18-11-12-19(20(17-18)27(22,23)24)26-16-15-25-14-9-13-21;3-1-2-4/h11-12,17H,2-10,14-16H2,1H3,(H,22,23,24);4H,1-3H2