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2-[(5-methoxy-2-nitro-phenyl)amino]-3-methylsulfanyl-propanoic acid

2-[(5-methoxy-2-nitro-phenyl)amino]-3-methylsulfanyl-propanoic acid

Systemtic Name:2-[(5-methoxy-2-nitro-phenyl)amino]-3-methylsulfanyl-propanoic acid
Openeye Name:2-(5-methoxy-2-nitro-anilino)-3-methylsulfanyl-propanoic acid
CAS Name:2-(5-methoxy-2-nitroanilino)-3-(methylthio)propanoic acid
IUPAC Name:2-(5-methoxy-2-nitroanilino)-3-methylsulfanylpropanoic acid
Traditional Name:2-(5-methoxy-2-nitro-anilino)-3-(methylthio)propionic acid
Formula: C11H14N2O5S
MolecularWeight: 286.30426
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+](=O)[O-])NC(CSC)C(=O)O


Isomeric SMILES

COC1=CC(=C(C=C1)[N+](=O)[O-])NC(CSC)C(=O)O


InChI

InChI=1S/C11H14N2O5S/c1-18-7-3-4-10(13(16)17)8(5-7)12-9(6-19-2)11(14)15/h3-5,9,12H,6H2,1-2H3,(H,14,15)


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