(E)-4-(3,4-dichlorophenyl)-3-nitro-but-3-en-2-one

Systemtic Name: (E)-4-(3,4-dichlorophenyl)-3-nitro-but-3-en-2-one Openeye Name: (E)-4-(3,4-dichlorophenyl)-3-nitro-but-3-en-2-one CAS Name: (E)-4-(3,4-dichlorophenyl)-3-nitro-3-buten-2-one IUPAC Name: (E)-4-(3,4-dichlorophenyl)-3-nitrobut-3-en-2-one Traditional Name: (E)-4-(3,4-dichlorophenyl)-3-nitro-but-3-en-2-one Formula: C10H7Cl2NO3 MolecularWeight: 260.07348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7Cl2NO3/c1-6(14)10(13(15)16)5-7-2-3-8(11)9(12)4-7/h2-5H,1H3/b10-5+