4-(2-nitrophenyl)sulfanylbutanoic acid

Systemtic Name: 4-(2-nitrophenyl)sulfanylbutanoic acid Openeye Name: 4-(2-nitrophenyl)sulfanylbutanoic acid CAS Name: 4-[(2-nitrophenyl)thio]butanoic acid IUPAC Name: 4-(2-nitrophenyl)sulfanylbutanoic acid Traditional Name: 4-[(2-nitrophenyl)thio]butyric acid Formula: C10H11NO4S MolecularWeight: 241.26364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4S/c12-10(13)6-3-7-16-9-5-2-1-4-8(9)11(14)15/h1-2,4-5H,3,6-7H2,(H,12,13)