(2R)-2-[(4-nitrophenyl)methylsulfanyl]propanoic acid

Systemtic Name: (2R)-2-[(4-nitrophenyl)methylsulfanyl]propanoic acid Openeye Name: (2R)-2-[(4-nitrophenyl)methylsulfanyl]propanoic acid CAS Name: (2R)-2-[(4-nitrophenyl)methylthio]propanoic acid IUPAC Name: (2R)-2-[(4-nitrophenyl)methylsulfanyl]propanoic acid Traditional Name: (2R)-2-[(4-nitrobenzyl)thio]propionic acid Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4S/c1-7(10(12)13)16-6-8-2-4-9(5-3-8)11(14)15/h2-5,7H,6H2,1H3,(H,12,13)/t7-/m1/s1