4-chloranyl-N-[[5-[1-methanoyl-4-(2-nitrophenyl)piperazin-1-ium-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-[1-methanoyl-4-(2-nitrophenyl)piperazin-1-ium-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[1-formyl-4-(2-nitrophenyl)piperazin-1-ium-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[1-formyl-4-(2-nitrophenyl)-1-piperazin-1-iumyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[1-formyl-4-(2-nitrophenyl)piperazin-1-ium-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[1-formyl-4-(2-nitrophenyl)piperazin-1-ium-1-yl]sulfonyl-2-thienyl]methyl]benzamide Formula: C23H22ClN4O6S2+ MolecularWeight: 550.02698

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1C2=CC=CC=C2[N+](=O)[O-])(C=O)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[N+](CCN1C2=CC=CC=C2[N+](=O)[O-])(C=O)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H21ClN4O6S2/c24-18-7-5-17(6-8-18)23(30)25-15-19-9-10-22(35-19)36(33,34)28(16-29)13-11-26(12-14-28)20-3-1-2-4-21(20)27(31)32/h1-10,16H,11-15H2/p+1