2-[[4-[4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-[4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-[4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-[4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-[4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 3-methyl-2-[[4-(4-methylolphenyl)phenyl]sulfonylamino]butyric acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5S/c1-12(2)17(18(21)22)19-25(23,24)16-9-7-15(8-10-16)14-5-3-13(11-20)4-6-14/h3-10,12,17,19-20H,11H2,1-2H3,(H,21,22)