5-(4-chlorophenyl)sulfanyl-2-nitro-benzenecarbonitrile

Systemtic Name: 5-(4-chlorophenyl)sulfanyl-2-nitro-benzenecarbonitrile Openeye Name: 5-(4-chlorophenyl)sulfanyl-2-nitro-benzonitrile CAS Name: 5-[(4-chlorophenyl)thio]-2-nitrobenzonitrile IUPAC Name: 5-(4-chlorophenyl)sulfanyl-2-nitrobenzonitrile Traditional Name: 5-[(4-chlorophenyl)thio]-2-nitro-benzonitrile Formula: C13H7ClN2O2S MolecularWeight: 290.72488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=CC(=C(C=C2)[N+](=O)[O-])C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=CC(=C(C=C2)[N+](=O)[O-])C#N)Cl

InChI

InChI=1S/C13H7ClN2O2S/c14-10-1-3-11(4-2-10)19-12-5-6-13(16(17)18)9(7-12)8-15/h1-7H