N-[2-(1-adamantyl)propan-2-yl]-2-[(2S)-1-methyl-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[2-(1-adamantyl)propan-2-yl]-2-[(2S)-1-methyl-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[1-(1-adamantyl)-1-methyl-ethyl]-2-[(2S)-1-methyl-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-[2-(1-adamantyl)propan-2-yl]-2-[(2S)-1-methyl-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(1-adamantyl)propan-2-yl]-2-[(2S)-1-methyl-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-[1-(1-adamantyl)-1-methyl-ethyl]-2-[(2S)-3-keto-1-methyl-piperazin-1-ium-2-yl]acetamide Formula: C20H34N3O2+ MolecularWeight: 348.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C12CC3CC(C1)CC(C3)C2)NC(=O)CC4C(=O)NCC[NH+]4C

Isomeric SMILES

CC(C)(C12CC3CC(C1)CC(C3)C2)NC(=O)C[C@H]4C(=O)NCC[NH+]4C

InChI

InChI=1S/C20H33N3O2/c1-19(2,20-10-13-6-14(11-20)8-15(7-13)12-20)22-17(24)9-16-18(25)21-4-5-23(16)3/h13-16H,4-12H2,1-3H3,(H,21,25)(H,22,24)/p+1/t13?,14?,15?,16-,20?/m0/s1