1-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]propan-1-one

Systemtic Name: 1-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]propan-1-one Openeye Name: 1-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]propan-1-one CAS Name: 1-[4-(4-methylsulfonyl-2-nitrophenoxy)phenyl]-1-propanone IUPAC Name: 1-[4-(4-methylsulfonyl-2-nitrophenoxy)phenyl]propan-1-one Traditional Name: 1-[4-(4-mesyl-2-nitro-phenoxy)phenyl]propan-1-one Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO6S/c1-3-15(18)11-4-6-12(7-5-11)23-16-9-8-13(24(2,21)22)10-14(16)17(19)20/h4-10H,3H2,1-2H3