2-[decanoyl-(3-dodecoxy-2-oxidanyl-propyl)amino]-2-oxidanyl-ethanesulfonic acid

Systemtic Name: 2-[decanoyl-(3-dodecoxy-2-oxidanyl-propyl)amino]-2-oxidanyl-ethanesulfonic acid Openeye Name: 2-[decanoyl-(3-dodecoxy-2-hydroxy-propyl)amino]-2-hydroxy-ethanesulfonic acid CAS Name: 2-[(3-dodecoxy-2-hydroxypropyl)-(1-oxodecyl)amino]-2-hydroxyethanesulfonic acid IUPAC Name: 2-[decanoyl-(3-dodecoxy-2-hydroxypropyl)amino]-2-hydroxyethanesulfonic acid Traditional Name: 2-[capryl-(2-hydroxy-3-lauryloxy-propyl)amino]-2-hydroxy-ethanesulfonic acid Formula: C27H55NO7S MolecularWeight: 537.7931

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(CN(C(CS(=O)(=O)O)O)C(=O)CCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCOCC(CN(C(CS(=O)(=O)O)O)C(=O)CCCCCCCCC)O

InChI

InChI=1S/C27H55NO7S/c1-3-5-7-9-11-12-13-15-17-19-21-35-23-25(29)22-28(27(31)24-36(32,33)34)26(30)20-18-16-14-10-8-6-4-2/h25,27,29,31H,3-24H2,1-2H3,(H,32,33,34)