4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoic acid

Systemtic Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoic acid Openeye Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butanoic acid CAS Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methylbutyl]phenyl]butanoic acid IUPAC Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methylbutyl]phenyl]butanoic acid Traditional Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-methyl-butyl]phenyl]butyric acid Formula: C21H26ClNO4S MolecularWeight: 423.95344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClNO4S/c1-15(2)14-20(23-28(26,27)19-12-10-18(22)11-13-19)17-8-6-16(7-9-17)4-3-5-21(24)25/h6-13,15,20,23H,3-5,14H2,1-2H3,(H,24,25)