N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methyl-amino]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methyl-amino]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methyl-amino]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methylamino]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(2-fluorophenyl)sulfonyl-methyl-amino]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C19H30FN4O4S+ MolecularWeight: 429.529303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C19H29FN4O4S/c1-19(2,3)21-17(25)13-23-9-11-24(12-10-23)18(26)14-22(4)29(27,28)16-8-6-5-7-15(16)20/h5-8H,9-14H2,1-4H3,(H,21,25)/p+1