3-[4-[(4-iodophenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoic acid

Systemtic Name: 3-[4-[(4-iodophenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: 3-[[1-hydroxy-4-[(4-iodophenyl)sulfonylamino]-2-naphthyl]sulfanyl]propanoic acid CAS Name: 3-[[1-hydroxy-4-[(4-iodophenyl)sulfonylamino]-2-naphthalenyl]thio]propanoic acid IUPAC Name: 3-[1-hydroxy-4-[(4-iodophenyl)sulfonylamino]naphthalen-2-yl]sulfanylpropanoic acid Traditional Name: 3-[[1-hydroxy-4-[(4-iodophenyl)sulfonylamino]-2-naphthyl]thio]propionic acid Formula: C19H16INO5S2 MolecularWeight: 529.36851

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)SCCC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)SCCC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C19H16INO5S2/c20-12-5-7-13(8-6-12)28(25,26)21-16-11-17(27-10-9-18(22)23)19(24)15-4-2-1-3-14(15)16/h1-8,11,21,24H,9-10H2,(H,22,23)