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4-[4-[5-methyl-1-(phenylsulfonylamino)hexyl]phenyl]butanoic acid

4-[4-[5-methyl-1-(phenylsulfonylamino)hexyl]phenyl]butanoic acid

Systemtic Name:4-[4-[5-methyl-1-(phenylsulfonylamino)hexyl]phenyl]butanoic acid
Openeye Name:4-[4-[1-(benzenesulfonamido)-5-methyl-hexyl]phenyl]butanoic acid
CAS Name:4-[4-[1-(benzenesulfonamido)-5-methylhexyl]phenyl]butanoic acid
IUPAC Name:4-[4-[1-(benzenesulfonamido)-5-methylhexyl]phenyl]butanoic acid
Traditional Name:4-[4-[1-(benzenesulfonamido)-5-methyl-hexyl]phenyl]butyric acid
Formula: C23H31NO4S
MolecularWeight: 417.56154
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C1=CC=C(C=C1)CCCC(=O)O)NS(=O)(=O)C2=CC=CC=C2


Isomeric SMILES

CC(C)CCCC(C1=CC=C(C=C1)CCCC(=O)O)NS(=O)(=O)C2=CC=CC=C2


InChI

InChI=1S/C23H31NO4S/c1-18(2)8-6-12-22(24-29(27,28)21-10-4-3-5-11-21)20-16-14-19(15-17-20)9-7-13-23(25)26/h3-5,10-11,14-18,22,24H,6-9,12-13H2,1-2H3,(H,25,26)


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