N-[(2S)-3-methyl-1-oxidanylidene-1-piperazin-4-ium-1-yl-butan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-piperazin-4-ium-1-yl-butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1S)-2-methyl-1-(piperazin-4-ium-1-carbonyl)propyl]cyclohexanecarboxamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-(1-piperazin-4-iumyl)butan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-piperazin-4-ium-1-ylbutan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1S)-2-methyl-1-(piperazin-4-ium-1-carbonyl)propyl]cyclohexanecarboxamide Formula: C16H30N3O2+ MolecularWeight: 296.4283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH2+]CC1)NC(=O)C2CCCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CC[NH2+]CC1)NC(=O)C2CCCCC2

InChI

InChI=1S/C16H29N3O2/c1-12(2)14(16(21)19-10-8-17-9-11-19)18-15(20)13-6-4-3-5-7-13/h12-14,17H,3-11H2,1-2H3,(H,18,20)/p+1/t14-/m0/s1