4-methyl-1-(4-methyl-2-nitro-phenyl)sulfanyl-2-nitro-benzene

Systemtic Name: 4-methyl-1-(4-methyl-2-nitro-phenyl)sulfanyl-2-nitro-benzene Openeye Name: 4-methyl-1-(4-methyl-2-nitro-phenyl)sulfanyl-2-nitro-benzene CAS Name: 4-methyl-1-[(4-methyl-2-nitrophenyl)thio]-2-nitrobenzene IUPAC Name: 4-methyl-1-(4-methyl-2-nitrophenyl)sulfanyl-2-nitrobenzene Traditional Name: 4-methyl-1-[(4-methyl-2-nitro-phenyl)thio]-2-nitro-benzene Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O4S/c1-9-3-5-13(11(7-9)15(17)18)21-14-6-4-10(2)8-12(14)16(19)20/h3-8H,1-2H3