5-(4-nitrophenyl)sulfanyl-3-oxidanyl-pentanoic acid

Systemtic Name: 5-(4-nitrophenyl)sulfanyl-3-oxidanyl-pentanoic acid Openeye Name: 3-hydroxy-5-(4-nitrophenyl)sulfanyl-pentanoic acid CAS Name: 3-hydroxy-5-[(4-nitrophenyl)thio]pentanoic acid IUPAC Name: 3-hydroxy-5-(4-nitrophenyl)sulfanylpentanoic acid Traditional Name: 3-hydroxy-5-[(4-nitrophenyl)thio]valeric acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SCCC(CC(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SCCC(CC(=O)O)O

InChI

InChI=1S/C11H13NO5S/c13-9(7-11(14)15)5-6-18-10-3-1-8(2-4-10)12(16)17/h1-4,9,13H,5-7H2,(H,14,15)