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

Systemtic Name: N-butyl-2-[4-[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-(2,6-diethylanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-(2,6-diethylanilino)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(2,6-diethylanilino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(2,6-diethylanilino)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C22H37N4O2+ MolecularWeight: 389.55478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C=CC=C2CC)CC

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C=CC=C2CC)CC

InChI

InChI=1S/C22H36N4O2/c1-4-7-11-23-20(27)16-25-12-14-26(15-13-25)17-21(28)24-22-18(5-2)9-8-10-19(22)6-3/h8-10H,4-7,11-17H2,1-3H3,(H,23,27)(H,24,28)/p+1