[3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenyl] 2-(2-morpholin-4-ylethylsulfamoyl)benzenesulfonate

Systemtic Name: [3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenyl] 2-(2-morpholin-4-ylethylsulfamoyl)benzenesulfonate Openeye Name: [3-[carbamimidoyl(propoxy)amino]oxy-5-methyl-phenyl] 2-(2-morpholinoethylsulfamoyl)benzenesulfonate CAS Name: 2-[2-(4-morpholinyl)ethylsulfamoyl]benzenesulfonic acid [3-[carbamimidoyl(propoxy)amino]oxy-5-methylphenyl] ester IUPAC Name: [3-[carbamimidoyl(propoxy)amino]oxy-5-methylphenyl] 2-(2-morpholin-4-ylethylsulfamoyl)benzenesulfonate Traditional Name: 2-(2-morpholinoethylsulfamoyl)benzenesulfonic acid [3-[amidino(propoxy)amino]oxy-5-methyl-phenyl] ester Formula: C23H33N5O8S2 MolecularWeight: 571.66682

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Descriptors Computed from Structure

Canonical SMILES:

CCCON(C(=N)N)OC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)NCCN3CCOCC3

Isomeric SMILES

CCCON(C(=N)N)OC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2S(=O)(=O)NCCN3CCOCC3

InChI

InChI=1S/C23H33N5O8S2/c1-3-12-34-28(23(24)25)35-19-15-18(2)16-20(17-19)36-38(31,32)22-7-5-4-6-21(22)37(29,30)26-8-9-27-10-13-33-14-11-27/h4-7,15-17,26H,3,8-14H2,1-2H3,(H3,24,25)