2-(2-hydroxyethylsulfanyl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2-hydroxyethylsulfanyl)-5-nitro-benzenecarbonitrile Openeye Name: 2-(2-hydroxyethylsulfanyl)-5-nitro-benzonitrile CAS Name: 2-(2-hydroxyethylthio)-5-nitrobenzonitrile IUPAC Name: 2-(2-hydroxyethylsulfanyl)-5-nitrobenzonitrile Traditional Name: 2-(2-hydroxyethylthio)-5-nitro-benzonitrile Formula: C9H8N2O3S MolecularWeight: 224.23642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O3S/c10-6-7-5-8(11(13)14)1-2-9(7)15-4-3-12/h1-2,5,12H,3-4H2