1-[4-(3-nitrothiophen-2-yl)sulfanylphenyl]ethanone

Systemtic Name: 1-[4-(3-nitrothiophen-2-yl)sulfanylphenyl]ethanone Openeye Name: 1-[4-[(3-nitro-2-thienyl)sulfanyl]phenyl]ethanone CAS Name: 1-[4-[(3-nitro-2-thiophenyl)thio]phenyl]ethanone IUPAC Name: 1-[4-(3-nitrothiophen-2-yl)sulfanylphenyl]ethanone Traditional Name: 1-[4-[(3-nitro-2-thienyl)thio]phenyl]ethanone Formula: C12H9NO3S2 MolecularWeight: 279.33476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)SC2=C(C=CS2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)SC2=C(C=CS2)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO3S2/c1-8(14)9-2-4-10(5-3-9)18-12-11(13(15)16)6-7-17-12/h2-7H,1H3