1-methyl-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanoyl]pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanoyl]pyrrole-2-carboxamide Openeye Name: 1-methyl-N-[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetyl]pyrrole-2-carboxamide CAS Name: 1-methyl-N-[2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-1-oxoethyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetyl]pyrrole-2-carboxamide Traditional Name: 1-methyl-N-[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetyl]pyrrole-2-carboxamide Formula: C22H25N4O4S+ MolecularWeight: 441.5233

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N4O4S/c1-24-10-4-7-20(24)22(28)23-21(27)16-25-11-13-26(14-12-25)31(29,30)19-9-8-17-5-2-3-6-18(17)15-19/h2-10,15H,11-14,16H2,1H3,(H,23,27,28)/p+1