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

Systemtic Name: 2-[4-[(4-tert-butylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]sulfanyl]propanoic acid CAS Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthalenyl]thio]propanoic acid IUPAC Name: 2-[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[4-[(4-tert-butylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]thio]propionic acid Formula: C23H25NO5S2 MolecularWeight: 459.5783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CC(C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C23H25NO5S2/c1-14(22(26)27)30-20-13-19(17-7-5-6-8-18(17)21(20)25)24-31(28,29)16-11-9-15(10-12-16)23(2,3)4/h5-14,24-25H,1-4H3,(H,26,27)