dimethyl-[[2-[[3-[(4-methylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[2-[[3-[(4-methylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[2-[[3-(p-tolylsulfonylamino)propanoylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[2-[[[3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[2-[[3-[(4-methylphenyl)sulfonylamino]propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[2-[[3-(tosylamino)propanoylamino]methyl]benzyl]ammonium Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2C[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2C[NH+](C)C

InChI

InChI=1S/C20H27N3O3S/c1-16-8-10-19(11-9-16)27(25,26)22-13-12-20(24)21-14-17-6-4-5-7-18(17)15-23(2)3/h4-11,22H,12-15H2,1-3H3,(H,21,24)/p+1