2-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-4-fluoranyl-benzamide Openeye Name: 2-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-4-fluoro-benzamide CAS Name: 2-chloro-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]-4-fluorobenzamide IUPAC Name: 2-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]-4-fluorobenzamide Traditional Name: 2-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-4-fluoro-benzamide Formula: C23H29ClFN4O4S+ MolecularWeight: 512.017163

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C23H28ClFN4O4S/c1-2-27-7-9-28(10-8-27)22-6-4-18(34(31,32)29-11-13-33-14-12-29)16-21(22)26-23(30)19-5-3-17(25)15-20(19)24/h3-6,15-16H,2,7-14H2,1H3,(H,26,30)/p+1