[4-methyl-3-[methyl(2-pyridin-4-ylethyl)sulfamoyl]phenyl]methylazanium

Systemtic Name: [4-methyl-3-[methyl(2-pyridin-4-ylethyl)sulfamoyl]phenyl]methylazanium Openeye Name: [4-methyl-3-[methyl-[2-(4-pyridyl)ethyl]sulfamoyl]phenyl]methylammonium CAS Name: [4-methyl-3-[methyl(2-pyridin-4-ylethyl)sulfamoyl]phenyl]methylammonium IUPAC Name: [4-methyl-3-[methyl(2-pyridin-4-ylethyl)sulfamoyl]phenyl]methylazanium Traditional Name: [4-methyl-3-[methyl-[2-(4-pyridyl)ethyl]sulfamoyl]benzyl]ammonium Formula: C16H22N3O2S+ MolecularWeight: 320.42978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N(C)CCC2=CC=NC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N(C)CCC2=CC=NC=C2

InChI

InChI=1S/C16H21N3O2S/c1-13-3-4-15(12-17)11-16(13)22(20,21)19(2)10-7-14-5-8-18-9-6-14/h3-6,8-9,11H,7,10,12,17H2,1-2H3/p+1