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3-(2-nitrophenyl)sulfanylpropanoic acid

3-(2-nitrophenyl)sulfanylpropanoic acid

Systemtic Name:3-(2-nitrophenyl)sulfanylpropanoic acid
Openeye Name:3-(2-nitrophenyl)sulfanylpropanoic acid
CAS Name:3-[(2-nitrophenyl)thio]propanoic acid
IUPAC Name:3-(2-nitrophenyl)sulfanylpropanoic acid
Traditional Name:3-[(2-nitrophenyl)thio]propionic acid
Formula: C9H9NO4S
MolecularWeight: 227.23706
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H9NO4S/c11-9(12)5-6-15-8-4-2-1-3-7(8)10(13)14/h1-4H,5-6H2,(H,11,12)


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