4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[[(2R)-2-oxolanyl]methyl]benzamide IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C17H26N3O4S+ MolecularWeight: 368.47104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3CCCO3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C17H25N3O4S/c1-19-8-10-20(11-9-19)25(22,23)16-6-4-14(5-7-16)17(21)18-13-15-3-2-12-24-15/h4-7,15H,2-3,8-13H2,1H3,(H,18,21)/p+1/t15-/m1/s1