2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: 2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: 2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: 2-methoxy-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C13H20N3O4S+ MolecularWeight: 314.3806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N

InChI

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