2-[bis[3-[octyl(2-oxidanylethanoyl)amino]-2-oxidanyl-propyl]amino]ethanesulfonic acid

Systemtic Name: 2-[bis[3-[octyl(2-oxidanylethanoyl)amino]-2-oxidanyl-propyl]amino]ethanesulfonic acid Openeye Name: 2-[bis[2-hydroxy-3-[(2-hydroxyacetyl)-octyl-amino]propyl]amino]ethanesulfonic acid CAS Name: 2-[bis[2-hydroxy-3-[(2-hydroxy-1-oxoethyl)-octylamino]propyl]amino]ethanesulfonic acid IUPAC Name: 2-[bis[2-hydroxy-3-[(2-hydroxyacetyl)-octylamino]propyl]amino]ethanesulfonic acid Traditional Name: 2-[bis[3-[glycoloyl(octyl)amino]-2-hydroxy-propyl]amino]ethanesulfonic acid Formula: C28H57N3O9S MolecularWeight: 611.83188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC(CN(CCS(=O)(=O)O)CC(CN(CCCCCCCC)C(=O)CO)O)O)C(=O)CO

Isomeric SMILES

CCCCCCCCN(CC(CN(CCS(=O)(=O)O)CC(CN(CCCCCCCC)C(=O)CO)O)O)C(=O)CO

InChI

InChI=1S/C28H57N3O9S/c1-3-5-7-9-11-13-15-30(27(36)23-32)21-25(34)19-29(17-18-41(38,39)40)20-26(35)22-31(28(37)24-33)16-14-12-10-8-6-4-2/h25-26,32-35H,3-24H2,1-2H3,(H,38,39,40)