1-[4-(4-methylsulfanylphenoxy)-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-(4-methylsulfanylphenoxy)-3-nitro-phenyl]ethanone Openeye Name: 1-[4-(4-methylsulfanylphenoxy)-3-nitro-phenyl]ethanone CAS Name: 1-[4-[4-(methylthio)phenoxy]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-(4-methylsulfanylphenoxy)-3-nitrophenyl]ethanone Traditional Name: 1-[4-[4-(methylthio)phenoxy]-3-nitro-phenyl]ethanone Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO4S/c1-10(17)11-3-8-15(14(9-11)16(18)19)20-12-4-6-13(21-2)7-5-12/h3-9H,1-2H3