1-(4-chloranyl-3-methylsulfanyl-phenyl)-2-nitro-ethanone

Systemtic Name: 1-(4-chloranyl-3-methylsulfanyl-phenyl)-2-nitro-ethanone Openeye Name: 1-(4-chloro-3-methylsulfanyl-phenyl)-2-nitro-ethanone CAS Name: 1-[4-chloro-3-(methylthio)phenyl]-2-nitroethanone IUPAC Name: 1-(4-chloro-3-methylsulfanylphenyl)-2-nitroethanone Traditional Name: 1-[4-chloro-3-(methylthio)phenyl]-2-nitro-ethanone Formula: C9H8ClNO3S MolecularWeight: 245.68272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClNO3S/c1-15-9-4-6(2-3-7(9)10)8(12)5-11(13)14/h2-4H,5H2,1H3