azanium; bicyclo[2.2.1]hepta-1,3,5-triene-7-carbonitrile; methanesulfonate

Systemtic Name: azanium; bicyclo[2.2.1]hepta-1,3,5-triene-7-carbonitrile; methanesulfonate Openeye Name: ammonium; bicyclo[2.2.1]hepta-1,3,5-triene-7-carbonitrile; methanesulfonate CAS Name: ammonium; 7-bicyclo[2.2.1]hepta-1,3,5-trienecarbonitrile; methanesulfonate IUPAC Name: azanium; bicyclo[2.2.1]hepta-1,3,5-triene-7-carbonitrile; methanesulfonate Traditional Name: ammonium bicyclo[2.2.1]hepta-1,3,5-triene-7-carbonitrile mesylate Formula: C9H12N2O3S MolecularWeight: 228.26818

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC2=CC=C1C2C#N.[NH4+]

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC2=CC=C1C2C#N.[NH4+]

InChI

InChI=1S/C8H5N.CH4O3S.H3N/c9-5-8-6-1-2-7(8)4-3-6;1-5(2,3)4;/h1-4,8H;1H3,(H,2,3,4);1H3