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5-decyl-3-(1,3-diphenylbutyl)-2-oxidanyl-benzenesulfonic acid

5-decyl-3-(1,3-diphenylbutyl)-2-oxidanyl-benzenesulfonic acid

Systemtic Name:5-decyl-3-(1,3-diphenylbutyl)-2-oxidanyl-benzenesulfonic acid
Openeye Name:5-decyl-3-(1,3-diphenylbutyl)-2-hydroxy-benzenesulfonic acid
CAS Name:5-decyl-3-(1,3-diphenylbutyl)-2-hydroxybenzenesulfonic acid
IUPAC Name:5-decyl-3-(1,3-diphenylbutyl)-2-hydroxybenzenesulfonic acid
Traditional Name:5-decyl-3-(1,3-diphenylbutyl)-2-hydroxy-besylic acid
Formula: C32H42O4S
MolecularWeight: 522.73848
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3


Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3


InChI

InChI=1S/C32H42O4S/c1-3-4-5-6-7-8-9-12-17-26-23-30(32(33)31(24-26)37(34,35)36)29(28-20-15-11-16-21-28)22-25(2)27-18-13-10-14-19-27/h10-11,13-16,18-21,23-25,29,33H,3-9,12,17,22H2,1-2H3,(H,34,35,36)


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