3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzamide Traditional Name: N-[3-[(2-ketopyrrolidino)methyl]phenyl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C23H29N4O4S+ MolecularWeight: 457.56576

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)CN4CCCC4=O

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)CN4CCCC4=O

InChI

InChI=1S/C23H28N4O4S/c1-25-11-13-27(14-12-25)32(30,31)21-8-3-6-19(16-21)23(29)24-20-7-2-5-18(15-20)17-26-10-4-9-22(26)28/h2-3,5-8,15-16H,4,9-14,17H2,1H3,(H,24,29)/p+1