N-butyl-2-[4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-(2-keto-2-mesidino-ethyl)piperazin-1-ium-1-yl]acetamide Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C21H34N4O2/c1-5-6-7-22-19(26)14-24-8-10-25(11-9-24)15-20(27)23-21-17(3)12-16(2)13-18(21)4/h12-13H,5-11,14-15H2,1-4H3,(H,22,26)(H,23,27)/p+1