(2R)-2-[4-[(2,5-dimethylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[4-[(2,5-dimethylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[[4-[(2,5-dimethylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]sulfanyl]propanoate CAS Name: (2R)-2-[[4-[(2,5-dimethylphenyl)sulfonylamino]-1-hydroxy-2-naphthalenyl]thio]propanoate IUPAC Name: (2R)-2-[4-[(2,5-dimethylphenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[4-[(2,5-dimethylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]thio]propionate Formula: C21H20NO5S2- MolecularWeight: 430.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)S[C@H](C)C(=O)[O-]

InChI

InChI=1S/C21H21NO5S2/c1-12-8-9-13(2)19(10-12)29(26,27)22-17-11-18(28-14(3)21(24)25)20(23)16-7-5-4-6-15(16)17/h4-11,14,22-23H,1-3H3,(H,24,25)/p-1/t14-/m1/s1