2-[4-[(5-nitrothiophen-2-yl)methylideneamino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(5-nitrothiophen-2-yl)methylideneamino]phenyl]ethanenitrile Openeye Name: 2-[4-[(5-nitro-2-thienyl)methyleneamino]phenyl]acetonitrile CAS Name: 2-[4-[(5-nitro-2-thiophenyl)methylideneamino]phenyl]acetonitrile IUPAC Name: 2-[4-[(5-nitrothiophen-2-yl)methylideneamino]phenyl]acetonitrile Traditional Name: 2-[4-[(5-nitro-2-thienyl)methyleneamino]phenyl]acetonitrile Formula: C13H9N3O2S MolecularWeight: 271.29446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)N=CC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC#N)N=CC2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O2S/c14-8-7-10-1-3-11(4-2-10)15-9-12-5-6-13(19-12)16(17)18/h1-6,9H,7H2