[(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[3-[bis(cyanomethyl)sulfamoyl]phenyl]ethyl]ammonium Formula: C12H15N4O2S+ MolecularWeight: 279.3381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)S(=O)(=O)N(CC#N)CC#N)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)S(=O)(=O)N(CC#N)CC#N)[NH3+]

InChI

InChI=1S/C12H14N4O2S/c1-10(15)11-3-2-4-12(9-11)19(17,18)16(7-5-13)8-6-14/h2-4,9-10H,7-8,15H2,1H3/p+1/t10-/m0/s1