N-tert-butyl-2-[4-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C20H32ClN4O2+ MolecularWeight: 395.94668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2CC[NH+](CC2)CC(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2CC[NH+](CC2)CC(=O)NC(C)(C)C)C

InChI

InChI=1S/C20H31ClN4O2/c1-14-10-15(2)19(16(21)11-14)22-17(26)12-24-6-8-25(9-7-24)13-18(27)23-20(3,4)5/h10-11H,6-9,12-13H2,1-5H3,(H,22,26)(H,23,27)/p+1