(E)-3-(4-methylsulfanyl-3-nitro-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylsulfanyl-3-nitro-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-methylsulfanyl-3-nitro-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(methylthio)-3-nitrophenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-methylsulfanyl-3-nitrophenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(methylthio)-3-nitro-phenyl]-1-phenyl-prop-2-en-1-one Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C=CC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO3S/c1-21-16-10-8-12(11-14(16)17(19)20)7-9-15(18)13-5-3-2-4-6-13/h2-11H,1H3/b9-7+