2-(2-nitro-5-phenylsulfanyl-phenyl)ethanenitrile

Systemtic Name: 2-(2-nitro-5-phenylsulfanyl-phenyl)ethanenitrile Openeye Name: 2-(2-nitro-5-phenylsulfanyl-phenyl)acetonitrile CAS Name: 2-[2-nitro-5-(phenylthio)phenyl]acetonitrile IUPAC Name: 2-(2-nitro-5-phenylsulfanylphenyl)acetonitrile Traditional Name: 2-[2-nitro-5-(phenylthio)phenyl]acetonitrile Formula: C14H10N2O2S MolecularWeight: 270.3064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N2O2S/c15-9-8-11-10-13(6-7-14(11)16(17)18)19-12-4-2-1-3-5-12/h1-7,10H,8H2