(E)-2-iodanyl-1-(4-nitrophenyl)hept-1-en-3-one

Systemtic Name: (E)-2-iodanyl-1-(4-nitrophenyl)hept-1-en-3-one Openeye Name: (E)-2-iodo-1-(4-nitrophenyl)hept-1-en-3-one CAS Name: (E)-2-iodo-1-(4-nitrophenyl)-1-hepten-3-one IUPAC Name: (E)-2-iodo-1-(4-nitrophenyl)hept-1-en-3-one Traditional Name: (E)-2-iodo-1-(4-nitrophenyl)hept-1-en-3-one Formula: C13H14INO3 MolecularWeight: 359.15963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])I

Isomeric SMILES

CCCCC(=O)/C(=C\C1=CC=C(C=C1)[N+](=O)[O-])/I

InChI

InChI=1S/C13H14INO3/c1-2-3-4-13(16)12(14)9-10-5-7-11(8-6-10)15(17)18/h5-9H,2-4H2,1H3/b12-9+