1,3-bis[dodecyl(2-sulfooxyethyl)amino]propan-2-yl hydrogen sulfate

Systemtic Name: 1,3-bis[dodecyl(2-sulfooxyethyl)amino]propan-2-yl hydrogen sulfate Openeye Name: 2-[dodecyl-[3-[dodecyl(2-sulfooxyethyl)amino]-2-sulfooxy-propyl]amino]ethyl hydrogen sulfate CAS Name: sulfuric acid 1,3-bis[dodecyl(2-sulfooxyethyl)amino]propan-2-yl ester IUPAC Name: 1,3-bis[dodecyl(2-sulfooxyethyl)amino]propan-2-yl hydrogen sulfate Traditional Name: sulfuric acid 2-[lauryl-[3-[lauryl(2-sulfoxyethyl)amino]-2-sulfoxy-propyl]amino]ethyl ester Formula: C31H66N2O12S3 MolecularWeight: 755.05694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCOS(=O)(=O)O)CC(CN(CCCCCCCCCCCC)CCOS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCN(CCOS(=O)(=O)O)CC(CN(CCCCCCCCCCCC)CCOS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C31H66N2O12S3/c1-3-5-7-9-11-13-15-17-19-21-23-32(25-27-43-46(34,35)36)29-31(45-48(40,41)42)30-33(26-28-44-47(37,38)39)24-22-20-18-16-14-12-10-8-6-4-2/h31H,3-30H2,1-2H3,(H,34,35,36)(H,37,38,39)(H,40,41,42)