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

Systemtic Name: 1-[(1E)-4,4-bis(methylsulfanyl)-2-nitro-buta-1,3-dienyl]-4-chloranyl-benzene Openeye Name: 1-[(1E)-4,4-bis(methylsulfanyl)-2-nitro-buta-1,3-dienyl]-4-chloro-benzene CAS Name: 1-[(1E)-4,4-bis(methylthio)-2-nitrobuta-1,3-dienyl]-4-chlorobenzene IUPAC Name: 1-[(1E)-4,4-bis(methylsulfanyl)-2-nitrobuta-1,3-dienyl]-4-chlorobenzene Traditional Name: 1-[(1E)-4,4-bis(methylthio)-2-nitro-buta-1,3-dienyl]-4-chloro-benzene Formula: C12H12ClNO2S2 MolecularWeight: 301.81218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClNO2S2/c1-17-12(18-2)8-11(14(15)16)7-9-3-5-10(13)6-4-9/h3-8H,1-2H3/b11-7+