2-azaniumylethyl-[(4-cyanophenyl)methylsulfonyl]azanide

Systemtic Name: 2-azaniumylethyl-[(4-cyanophenyl)methylsulfonyl]azanide Openeye Name: 2-azaniumylethyl-[(4-cyanophenyl)methylsulfonyl]azanide CAS Name: 2-ammonioethyl-[(4-cyanophenyl)methylsulfonyl]azanide IUPAC Name: 2-azaniumylethyl-[(4-cyanophenyl)methylsulfonyl]azanide Traditional Name: 2-ammonioethyl-(4-cyanobenzyl)sulfonyl-azanide Formula: C10H13N3O2S MolecularWeight: 239.29412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)[N-]CC[NH3+])C#N

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)[N-]CC[NH3+])C#N

InChI

InChI=1S/C10H12N3O2S/c11-5-6-13-16(14,15)8-10-3-1-9(7-12)2-4-10/h1-4H,5-6,8,11H2/q-1/p+1