(E)-4-(2-nitrophenyl)sulfonylbut-3-en-2-one

Systemtic Name: (E)-4-(2-nitrophenyl)sulfonylbut-3-en-2-one Openeye Name: (E)-4-(2-nitrophenyl)sulfonylbut-3-en-2-one CAS Name: (E)-4-(2-nitrophenyl)sulfonyl-3-buten-2-one IUPAC Name: (E)-4-(2-nitrophenyl)sulfonylbut-3-en-2-one Traditional Name: (E)-4-(2-nitrophenyl)sulfonylbut-3-en-2-one Formula: C10H9NO5S MolecularWeight: 255.24716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5S/c1-8(12)6-7-17(15,16)10-5-3-2-4-9(10)11(13)14/h2-7H,1H3/b7-6+