(2R)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]propanoate

Systemtic Name: (2R)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]propanoate Openeye Name: (2R)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(4-methoxy-3-nitrophenyl)methylthio]propanoate IUPAC Name: (2R)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(4-methoxy-3-nitro-benzyl)thio]propionate Formula: C11H12NO5S- MolecularWeight: 270.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)[O-])SCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO5S/c1-7(11(13)14)18-6-8-3-4-10(17-2)9(5-8)12(15)16/h3-5,7H,6H2,1-2H3,(H,13,14)/p-1/t7-/m1/s1