(2R)-2-[1-oxidanyl-4-[(4-propan-2-ylphenyl)sulfonylamino]naphthalen-2-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[1-oxidanyl-4-[(4-propan-2-ylphenyl)sulfonylamino]naphthalen-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[[1-hydroxy-4-[(4-isopropylphenyl)sulfonylamino]-2-naphthyl]sulfanyl]propanoate CAS Name: (2R)-2-[[1-hydroxy-4-[(4-propan-2-ylphenyl)sulfonylamino]-2-naphthalenyl]thio]propanoate IUPAC Name: (2R)-2-[1-hydroxy-4-[(4-propan-2-ylphenyl)sulfonylamino]naphthalen-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[1-hydroxy-4-(p-cumenylsulfonylamino)-2-naphthyl]thio]propionate Formula: C22H22NO5S2- MolecularWeight: 444.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC(C)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=C(C=C3)C(C)C)O

InChI

InChI=1S/C22H23NO5S2/c1-13(2)15-8-10-16(11-9-15)30(27,28)23-19-12-20(29-14(3)22(25)26)21(24)18-7-5-4-6-17(18)19/h4-14,23-24H,1-3H3,(H,25,26)/p-1/t14-/m1/s1