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2-[(5-chloranyl-2-nitro-phenyl)methylsulfanyl]ethanoic acid

2-[(5-chloranyl-2-nitro-phenyl)methylsulfanyl]ethanoic acid

Systemtic Name:2-[(5-chloranyl-2-nitro-phenyl)methylsulfanyl]ethanoic acid
Openeye Name:2-[(5-chloro-2-nitro-phenyl)methylsulfanyl]acetic acid
CAS Name:2-[(5-chloro-2-nitrophenyl)methylthio]acetic acid
IUPAC Name:2-[(5-chloro-2-nitrophenyl)methylsulfanyl]acetic acid
Traditional Name:2-[(5-chloro-2-nitro-benzyl)thio]acetic acid
Formula: C9H8ClNO4S
MolecularWeight: 261.68212
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CSCC(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=C(C=C1Cl)CSCC(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C9H8ClNO4S/c10-7-1-2-8(11(14)15)6(3-7)4-16-5-9(12)13/h1-3H,4-5H2,(H,12,13)


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