4-(4-nitrophenyl)sulfanylbutanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4S/c12-10(13)2-1-7-16-9-5-3-8(4-6-9)11(14)15/h3-6H,1-2,7H2,(H,12,13)