sodium (2Z)-2-(4-methylphenyl)sulfonyl-2-oxidanidylimino-ethanenitrile

Systemtic Name: sodium (2Z)-2-(4-methylphenyl)sulfonyl-2-oxidanidylimino-ethanenitrile Openeye Name: sodium (1Z)-N-oxido-1-(p-tolylsulfonyl)formimidoyl cyanide CAS Name: sodium (2Z)-2-(4-methylphenyl)sulfonyl-2-oxidoiminoacetonitrile IUPAC Name: sodium (1Z)-1-(4-methylphenyl)sulfonyl-N-oxidomethanimidoyl cyanide Traditional Name: sodium (2Z)-2-oxidoimino-2-tosyl-acetonitrile Formula: C9H7N2NaO3S MolecularWeight: 246.21825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=N[O-])C#N.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=N\[O-])/C#N.[Na+]

InChI

InChI=1S/C9H8N2O3S.Na/c1-7-2-4-8(5-3-7)15(13,14)9(6-10)11-12;/h2-5,12H,1H3;/q;+1/p-1/b11-9-;