4-(4-methylpiperazin-1-yl)-3-(methylsulfonylamino)benzoic acid

Systemtic Name: 4-(4-methylpiperazin-1-yl)-3-(methylsulfonylamino)benzoic acid Openeye Name: 3-(methanesulfonamido)-4-(4-methylpiperazin-1-yl)benzoic acid CAS Name: 3-(methanesulfonamido)-4-(4-methyl-1-piperazinyl)benzoic acid IUPAC Name: 3-(methanesulfonamido)-4-(4-methylpiperazin-1-yl)benzoic acid Traditional Name: 3-(methanesulfonamido)-4-(4-methylpiperazino)benzoic acid Formula: C13H19N3O4S MolecularWeight: 313.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C13H19N3O4S/c1-15-5-7-16(8-6-15)12-4-3-10(13(17)18)9-11(12)14-21(2,19)20/h3-4,9,14H,5-8H2,1-2H3,(H,17,18)