2-[4-[(4-tert-butylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-[(4-tert-butylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]sulfanyl]acetic acid CAS Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthalenyl]thio]acetic acid IUPAC Name: 2-[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]thio]acetic acid Formula: C22H23NO5S2 MolecularWeight: 445.55172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SCC(=O)O

InChI

InChI=1S/C22H23NO5S2/c1-22(2,3)14-8-10-15(11-9-14)30(27,28)23-18-12-19(29-13-20(24)25)21(26)17-7-5-4-6-16(17)18/h4-12,23,26H,13H2,1-3H3,(H,24,25)