N-methyl-N'-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethyl]ethanediamide

Systemtic Name: N-methyl-N'-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethyl]ethanediamide Openeye Name: N-methyl-N'-[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]ethyl]oxamide CAS Name: N-methyl-N'-[2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N-methyl-N'-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethyl]oxamide Traditional Name: N-methyl-N'-[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]ethyl]oxamide Formula: C19H25N4O4S+ MolecularWeight: 405.4912

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=O)NCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CNC(=O)C(=O)NCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H24N4O4S/c1-20-18(24)19(25)21-8-9-22-10-12-23(13-11-22)28(26,27)17-7-6-15-4-2-3-5-16(15)14-17/h2-7,14H,8-13H2,1H3,(H,20,24)(H,21,25)/p+1