(E)-3-(3,5-dinitrophenyl)-1-(4-ethylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dinitrophenyl)-1-(4-ethylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3,5-dinitrophenyl)-1-(4-ethylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3,5-dinitrophenyl)-1-[4-(ethylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-dinitrophenyl)-1-(4-ethylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,5-dinitrophenyl)-1-[4-(ethylthio)phenyl]prop-2-en-1-one Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)C=CC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5S/c1-2-25-16-6-4-13(5-7-16)17(20)8-3-12-9-14(18(21)22)11-15(10-12)19(23)24/h3-11H,2H2,1H3/b8-3+