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2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid

2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid

Systemtic Name:2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid
Openeye Name:2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid
CAS Name:2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfo-9-octadecenoic acid
IUPAC Name:2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid
Traditional Name:2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-18-sulfooctadec-9-enoic acid
Formula: C24H49NO8S
MolecularWeight: 511.71276
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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCS(=O)(=O)O)CCCC=CCCCCCCCC(=O)O.C(CO)N(CCO)CCO


Isomeric SMILES

C(CCCCS(=O)(=O)O)CCC/C=C\CCCCCCCC(=O)O.C(CO)N(CCO)CCO


InChI

InChI=1S/C18H34O5S.C6H15NO3/c19-18(20)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-24(21,22)23;8-4-1-7(2-5-9)3-6-10/h1-2H,3-17H2,(H,19,20)(H,21,22,23);8-10H,1-6H2/b2-1-;


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