2-cyclopentylsulfanyl-5-nitro-benzenecarbonitrile

Systemtic Name: 2-cyclopentylsulfanyl-5-nitro-benzenecarbonitrile Openeye Name: 2-cyclopentylsulfanyl-5-nitro-benzonitrile CAS Name: 2-(cyclopentylthio)-5-nitrobenzonitrile IUPAC Name: 2-cyclopentylsulfanyl-5-nitrobenzonitrile Traditional Name: 2-(cyclopentylthio)-5-nitro-benzonitrile Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC(C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H12N2O2S/c13-8-9-7-10(14(15)16)5-6-12(9)17-11-3-1-2-4-11/h5-7,11H,1-4H2