diethyl-[[4-[[(2-methylsulfonylphenyl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[4-[[(2-methylsulfonylphenyl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[(2-methylsulfonylbenzoyl)amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[(2-methylsulfonylphenyl)-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[(2-methylsulfonylbenzoyl)amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[(2-mesylbenzoyl)amino]methyl]benzyl]ammonium Formula: C20H27N2O3S+ MolecularWeight: 375.50498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S/c1-4-22(5-2)15-17-12-10-16(11-13-17)14-21-20(23)18-8-6-7-9-19(18)26(3,24)25/h6-13H,4-5,14-15H2,1-3H3,(H,21,23)/p+1