4-methyl-2-[4-(phenylsulfonylamino)phenyl]pentanoic acid

Systemtic Name: 4-methyl-2-[4-(phenylsulfonylamino)phenyl]pentanoic acid Openeye Name: 2-[4-(benzenesulfonamido)phenyl]-4-methyl-pentanoic acid CAS Name: 2-[4-(benzenesulfonamido)phenyl]-4-methylpentanoic acid IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]-4-methylpentanoic acid Traditional Name: 2-[4-(benzenesulfonamido)phenyl]-4-methyl-valeric acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO4S/c1-13(2)12-17(18(20)21)14-8-10-15(11-9-14)19-24(22,23)16-6-4-3-5-7-16/h3-11,13,17,19H,12H2,1-2H3,(H,20,21)