2-(4-methylsulfanyl-2-nitro-phenoxy)ethanoic acid

Systemtic Name: 2-(4-methylsulfanyl-2-nitro-phenoxy)ethanoic acid Openeye Name: 2-(4-methylsulfanyl-2-nitro-phenoxy)acetic acid CAS Name: 2-[4-(methylthio)-2-nitrophenoxy]acetic acid IUPAC Name: 2-(4-methylsulfanyl-2-nitrophenoxy)acetic acid Traditional Name: 2-[4-(methylthio)-2-nitro-phenoxy]acetic acid Formula: C9H9NO5S MolecularWeight: 243.23646

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)OCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC(=C(C=C1)OCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO5S/c1-16-6-2-3-8(15-5-9(11)12)7(4-6)10(13)14/h2-4H,5H2,1H3,(H,11,12)