N,N-diethyl-2-[4-[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C23H30FN4O4S+ MolecularWeight: 477.572103

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H29FN4O4S/c1-3-27(4-2)22(29)17-26-13-15-28(16-14-26)23(30)18-5-9-20(10-6-18)25-33(31,32)21-11-7-19(24)8-12-21/h5-12,25H,3-4,13-17H2,1-2H3/p+1