2-[4-(4-nitrophenyl)sulfanylphenyl]ethanenitrile

Systemtic Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]ethanenitrile Openeye Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]acetonitrile CAS Name: 2-[4-[(4-nitrophenyl)thio]phenyl]acetonitrile IUPAC Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]acetonitrile Traditional Name: 2-[4-[(4-nitrophenyl)thio]phenyl]acetonitrile Formula: C14H10N2O2S MolecularWeight: 270.3064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC#N)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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