1-(2,4-dinitrophenyl)sulfanyl-4-methyl-2-nitro-benzene

Systemtic Name: 1-(2,4-dinitrophenyl)sulfanyl-4-methyl-2-nitro-benzene Openeye Name: 1-(2,4-dinitrophenyl)sulfanyl-4-methyl-2-nitro-benzene CAS Name: 1-[(2,4-dinitrophenyl)thio]-4-methyl-2-nitrobenzene IUPAC Name: 1-(2,4-dinitrophenyl)sulfanyl-4-methyl-2-nitrobenzene Traditional Name: 1-[(2,4-dinitrophenyl)thio]-4-methyl-2-nitro-benzene Formula: C13H9N3O6S MolecularWeight: 335.29206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O6S/c1-8-2-4-12(10(6-8)15(19)20)23-13-5-3-9(14(17)18)7-11(13)16(21)22/h2-7H,1H3