azanium N-(4-aminophenyl)sulfonyl-N-cyano-ethanamide hydrate

Systemtic Name: azanium N-(4-aminophenyl)sulfonyl-N-cyano-ethanamide hydrate Openeye Name: ammonium N-(4-aminophenyl)sulfonyl-N-cyano-acetamide hydrate CAS Name: ammonium N-(4-aminophenyl)sulfonyl-N-cyanoacetamide hydrate IUPAC Name: azanium N-(4-aminophenyl)sulfonyl-N-cyanoacetamide hydrate Traditional Name: ammonium N-cyano-N-sulfanilyl-acetamide hydrate Formula: C9H15N4O4S+ MolecularWeight: 275.3048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C#N)S(=O)(=O)C1=CC=C(C=C1)N.[NH4+].O

Isomeric SMILES

CC(=O)N(C#N)S(=O)(=O)C1=CC=C(C=C1)N.[NH4+].O

InChI

InChI=1S/C9H9N3O3S.H3N.H2O/c1-7(13)12(6-10)16(14,15)9-4-2-8(11)3-5-9;;/h2-5H,11H2,1H3;1H3;1H2/p+1