2-(4-chloranylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylphenyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidinosulfonyl-phenyl]acetamide Formula: C25H34ClN4O4S+ MolecularWeight: 522.07986

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H33ClN4O4S/c1-2-28-14-16-29(17-15-28)24-11-10-22(35(32,33)30-12-4-3-5-13-30)18-23(24)27-25(31)19-34-21-8-6-20(26)7-9-21/h6-11,18H,2-5,12-17,19H2,1H3,(H,27,31)/p+1