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3-oxidanyl-16-phenyl-heptadecane-2-sulfonic acid

3-oxidanyl-16-phenyl-heptadecane-2-sulfonic acid

Systemtic Name:3-oxidanyl-16-phenyl-heptadecane-2-sulfonic acid
Openeye Name:3-hydroxy-16-phenyl-heptadecane-2-sulfonic acid
CAS Name:3-hydroxy-16-phenyl-2-heptadecanesulfonic acid
IUPAC Name:3-hydroxy-16-phenylheptadecane-2-sulfonic acid
Traditional Name:3-hydroxy-16-phenyl-heptadecane-2-sulfonic acid
Formula: C23H40O4S
MolecularWeight: 412.6263
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCCC(C(C)S(=O)(=O)O)O)C1=CC=CC=C1


Isomeric SMILES

CC(CCCCCCCCCCCCC(C(C)S(=O)(=O)O)O)C1=CC=CC=C1


InChI

InChI=1S/C23H40O4S/c1-20(22-17-13-11-14-18-22)16-12-9-7-5-3-4-6-8-10-15-19-23(24)21(2)28(25,26)27/h11,13-14,17-18,20-21,23-24H,3-10,12,15-16,19H2,1-2H3,(H,25,26,27)


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