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

Systemtic Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-5-methyl-hexyl]phenyl]butanoic acid Openeye Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-5-methyl-hexyl]phenyl]butanoic acid CAS Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-5-methylhexyl]phenyl]butanoic acid IUPAC Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-5-methylhexyl]phenyl]butanoic acid Traditional Name: 4-[4-[1-(brosylamino)-5-methyl-hexyl]phenyl]butyric acid Formula: C23H30BrNO4S MolecularWeight: 496.4576

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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=C(C=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H30BrNO4S/c1-17(2)5-3-7-22(25-30(28,29)21-15-13-20(24)14-16-21)19-11-9-18(10-12-19)6-4-8-23(26)27/h9-17,22,25H,3-8H2,1-2H3,(H,26,27)