4-(4-cyano-2-nitro-phenyl)sulfanyl-3-nitro-benzenecarbonitrile

Systemtic Name: 4-(4-cyano-2-nitro-phenyl)sulfanyl-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-cyano-2-nitro-phenyl)sulfanyl-3-nitro-benzonitrile CAS Name: 4-[(4-cyano-2-nitrophenyl)thio]-3-nitrobenzonitrile IUPAC Name: 4-(4-cyano-2-nitrophenyl)sulfanyl-3-nitrobenzonitrile Traditional Name: 4-[(4-cyano-2-nitro-phenyl)thio]-3-nitro-benzonitrile Formula: C14H6N4O4S MolecularWeight: 326.28684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])SC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])SC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H6N4O4S/c15-7-9-1-3-13(11(5-9)17(19)20)23-14-4-2-10(8-16)6-12(14)18(21)22/h1-6H