1-methyl-2-(methylsulfanylmethyl)-4-nitro-benzene

Systemtic Name: 1-methyl-2-(methylsulfanylmethyl)-4-nitro-benzene Openeye Name: 1-methyl-2-(methylsulfanylmethyl)-4-nitro-benzene CAS Name: 1-methyl-2-[(methylthio)methyl]-4-nitrobenzene IUPAC Name: 1-methyl-2-(methylsulfanylmethyl)-4-nitrobenzene Traditional Name: 1-methyl-2-[(methylthio)methyl]-4-nitro-benzene Formula: C9H11NO2S MolecularWeight: 197.25414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO2S/c1-7-3-4-9(10(11)12)5-8(7)6-13-2/h3-5H,6H2,1-2H3