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

Systemtic Name: 2-(2-chloranyl-5-methyl-phenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]ethanamide Openeye Name: 2-(2-chloro-5-methyl-phenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2-chloro-5-methylphenoxy)-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2-chloro-5-methylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylphenyl]acetamide Traditional Name: 2-(2-chloro-5-methyl-phenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidinosulfonyl-phenyl]acetamide Formula: C26H36ClN4O4S+ MolecularWeight: 536.10644

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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=C(C=CC(=C4)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H35ClN4O4S/c1-3-29-13-15-30(16-14-29)24-10-8-21(36(33,34)31-11-5-4-6-12-31)18-23(24)28-26(32)19-35-25-17-20(2)7-9-22(25)27/h7-10,17-18H,3-6,11-16,19H2,1-2H3,(H,28,32)/p+1