1-chloranyl-2-nitro-4-[(4-nitrophenyl)sulfanylmethyl]benzene

Systemtic Name: 1-chloranyl-2-nitro-4-[(4-nitrophenyl)sulfanylmethyl]benzene Openeye Name: 1-chloro-2-nitro-4-[(4-nitrophenyl)sulfanylmethyl]benzene CAS Name: 1-chloro-2-nitro-4-[[(4-nitrophenyl)thio]methyl]benzene IUPAC Name: 1-chloro-2-nitro-4-[(4-nitrophenyl)sulfanylmethyl]benzene Traditional Name: 1-chloro-2-nitro-4-[[(4-nitrophenyl)thio]methyl]benzene Formula: C13H9ClN2O4S MolecularWeight: 324.73956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SCC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SCC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClN2O4S/c14-12-6-1-9(7-13(12)16(19)20)8-21-11-4-2-10(3-5-11)15(17)18/h1-7H,8H2