1-methyl-2-[(1E,3Z)-4-methylsulfanyl-2-nitro-buta-1,3-dienyl]benzene

Systemtic Name: 1-methyl-2-[(1E,3Z)-4-methylsulfanyl-2-nitro-buta-1,3-dienyl]benzene Openeye Name: 1-methyl-2-[(1E,3Z)-4-methylsulfanyl-2-nitro-buta-1,3-dienyl]benzene CAS Name: 1-methyl-2-[(1E,3Z)-4-(methylthio)-2-nitrobuta-1,3-dienyl]benzene IUPAC Name: 1-methyl-2-[(1E,3Z)-4-methylsulfanyl-2-nitrobuta-1,3-dienyl]benzene Traditional Name: 1-methyl-2-[(1E,3Z)-4-(methylthio)-2-nitro-buta-1,3-dienyl]benzene Formula: C12H13NO2S MolecularWeight: 235.30212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C=CSC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1/C=C(\C=C/SC)/[N+](=O)[O-]

InChI

InChI=1S/C12H13NO2S/c1-10-5-3-4-6-11(10)9-12(13(14)15)7-8-16-2/h3-9H,1-2H3/b8-7-,12-9+