dimethyl-[[4-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]methyl]phenyl]methyl]azanium Traditional Name: [4-[[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O3S/c1-23(2)15-17-8-6-16(7-9-17)14-22-21(25)19-10-11-20-18(13-19)5-4-12-24(20)28(3,26)27/h6-11,13H,4-5,12,14-15H2,1-3H3,(H,22,25)/p+1