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2-nitro-6-phenylsulfanyl-benzenecarbonitrile

2-nitro-6-phenylsulfanyl-benzenecarbonitrile

Systemtic Name:2-nitro-6-phenylsulfanyl-benzenecarbonitrile
Openeye Name:2-nitro-6-phenylsulfanyl-benzonitrile
CAS Name:2-nitro-6-(phenylthio)benzonitrile
IUPAC Name:2-nitro-6-phenylsulfanylbenzonitrile
Traditional Name:2-nitro-6-(phenylthio)benzonitrile
Formula: C13H8N2O2S
MolecularWeight: 256.27982
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC(=C2C#N)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC(=C2C#N)[N+](=O)[O-]


InChI

InChI=1S/C13H8N2O2S/c14-9-11-12(15(16)17)7-4-8-13(11)18-10-5-2-1-3-6-10/h1-8H


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