methyl-[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium Openeye Name: methyl-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]-[[2-(1-piperidyl)phenyl]methyl]ammonium CAS Name: methyl-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]-[[2-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: methyl-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium Traditional Name: [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl]-methyl-(2-piperidinobenzyl)ammonium Formula: C22H31N4O3S+ MolecularWeight: 431.57154

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H30N4O3S/c1-25(16-19-7-3-4-8-21(19)26-13-5-2-6-14-26)17-22(27)24-15-18-9-11-20(12-10-18)30(23,28)29/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,24,27)(H2,23,28,29)/p+1