ethyl 4-(cyanomethylsulfonyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(cyanomethylsulfonyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(cyanomethylsulfonyl)piperazine-1-carboxylate CAS Name: 4-(cyanomethylsulfonyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyanomethylsulfonyl)piperazine-1-carboxylate Traditional Name: 4-(cyanomethylsulfonyl)piperazine-1-carboxylic acid ethyl ester Formula: C9H15N3O4S MolecularWeight: 261.2981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)CC#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)CC#N

InChI

InChI=1S/C9H15N3O4S/c1-2-16-9(13)11-4-6-12(7-5-11)17(14,15)8-3-10/h2,4-8H2,1H3