N'-(4-methoxyphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-methoxyphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N'-(4-methoxyphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]oxamide CAS Name: N'-(4-methoxyphenyl)-N-[2-[4-(4-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N'-(4-methoxyphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]oxamide Traditional Name: N'-(4-methoxyphenyl)-N-[2-(4-nosylpiperazin-1-ium-1-yl)ethyl]oxamide Formula: C21H26N5O7S+ MolecularWeight: 492.52544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O7S/c1-33-18-6-2-16(3-7-18)23-21(28)20(27)22-10-11-24-12-14-25(15-13-24)34(31,32)19-8-4-17(5-9-19)26(29)30/h2-9H,10-15H2,1H3,(H,22,27)(H,23,28)/p+1