N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C19H30FN4O2+ MolecularWeight: 365.465503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29FN4O2/c1-19(2,3)21-17(25)13-22(4)18(26)14-23-9-11-24(12-10-23)16-7-5-15(20)6-8-16/h5-8H,9-14H2,1-4H3,(H,21,25)/p+1