(2E)-2-tert-butylsulfonyl-2-[(4-nitrophenyl)hydrazinylidene]ethanenitrile

Systemtic Name: (2E)-2-tert-butylsulfonyl-2-[(4-nitrophenyl)hydrazinylidene]ethanenitrile Openeye Name: (1E)-1-tert-butylsulfonyl-N-(4-nitroanilino)formimidoyl cyanide CAS Name: (2E)-2-tert-butylsulfonyl-2-[(4-nitrophenyl)hydrazinylidene]acetonitrile IUPAC Name: (1E)-1-tert-butylsulfonyl-N-(4-nitroanilino)methanimidoyl cyanide Traditional Name: (2E)-2-tert-butylsulfonyl-2-[(4-nitrophenyl)hydrazono]acetonitrile Formula: C12H14N4O4S MolecularWeight: 310.32896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C(=NNC1=CC=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)(C)S(=O)(=O)/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/C#N

InChI

InChI=1S/C12H14N4O4S/c1-12(2,3)21(19,20)11(8-13)15-14-9-4-6-10(7-5-9)16(17)18/h4-7,14H,1-3H3/b15-11+