methyl 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoate

Systemtic Name: methyl 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoate Openeye Name: methyl 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoate CAS Name: 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoate Traditional Name: 4-methyl-3-[3-(methylamino)propylsulfamoyl]benzoic acid methyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCCCNC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCCCNC

InChI

InChI=1S/C13H20N2O4S/c1-10-5-6-11(13(16)19-3)9-12(10)20(17,18)15-8-4-7-14-2/h5-6,9,14-15H,4,7-8H2,1-3H3