(E)-1-(4-methylsulfonylphenyl)-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylsulfonylphenyl)-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-methylsulfonylphenyl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(4-methylsulfonylphenyl)-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-methylsulfonylphenyl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-mesylphenyl)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5S/c1-23(21,22)15-8-6-13(7-9-15)16(18)10-5-12-3-2-4-14(11-12)17(19)20/h2-11H,1H3/b10-5+