7-[4-[[4-(methylsulfonylamino)phenyl]methyl]phenyl]heptanoic acid

Systemtic Name: 7-[4-[[4-(methylsulfonylamino)phenyl]methyl]phenyl]heptanoic acid Openeye Name: 7-[4-[[4-(methanesulfonamido)phenyl]methyl]phenyl]heptanoic acid CAS Name: 7-[4-[[4-(methanesulfonamido)phenyl]methyl]phenyl]heptanoic acid IUPAC Name: 7-[4-[[4-(methanesulfonamido)phenyl]methyl]phenyl]heptanoic acid Traditional Name: 7-[4-[4-(methanesulfonamido)benzyl]phenyl]enanthic acid Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)CCCCCCC(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)CCCCCCC(=O)O

InChI

InChI=1S/C21H27NO4S/c1-27(25,26)22-20-14-12-19(13-15-20)16-18-10-8-17(9-11-18)6-4-2-3-5-7-21(23)24/h8-15,22H,2-7,16H2,1H3,(H,23,24)