2-[4-[1-(4-chlorophenyl)cyclobutyl]carbonylpiperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[1-(4-chlorophenyl)cyclobutyl]carbonylpiperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[1-(4-chlorophenyl)cyclobutanecarbonyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[[1-(4-chlorophenyl)cyclobutyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[1-(4-chlorophenyl)cyclobutanecarbonyl]piperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-[1-(4-chlorophenyl)cyclobutanecarbonyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone Formula: C21H29ClN3O3+ MolecularWeight: 406.92626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC=C(C=C2)Cl)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

Isomeric SMILES

C1CC(C1)(C2=CC=C(C=C2)Cl)C(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C21H28ClN3O3/c22-18-4-2-17(3-5-18)21(6-1-7-21)20(27)25-10-8-23(9-11-25)16-19(26)24-12-14-28-15-13-24/h2-5H,1,6-16H2/p+1