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O1-sulfo O4-tridecyl 2-tridecylbutanedioate

O1-sulfo O4-tridecyl 2-tridecylbutanedioate

Systemtic Name:O1-sulfo O4-tridecyl 2-tridecylbutanedioate
Openeye Name:O1-sulfo O4-tridecyl 2-tridecylbutanedioate
CAS Name:2-tridecylbutanedioic acid O1-sulfo ester O4-tridecyl ester
IUPAC Name:1-O-sulfo 4-O-tridecyl 2-tridecylbutanedioate
Traditional Name:2-tridecylsuccinic acid O1-sulfo ester O4-tridecyl ester
Formula: C30H58O7S
MolecularWeight: 562.84232
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)OCCCCCCCCCCCCC)C(=O)OS(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)OCCCCCCCCCCCCC)C(=O)OS(=O)(=O)O


InChI

InChI=1S/C30H58O7S/c1-3-5-7-9-11-13-15-17-19-21-23-25-28(30(32)37-38(33,34)35)27-29(31)36-26-24-22-20-18-16-14-12-10-8-6-4-2/h28H,3-27H2,1-2H3,(H,33,34,35)


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