(3R)-N-tert-butyl-3-methyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide

Systemtic Name: (3R)-N-tert-butyl-3-methyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide Openeye Name: (3R)-N-tert-butyl-3-methyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide CAS Name: (3R)-N-tert-butyl-3-methyl-5-oxo-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentanamide IUPAC Name: (3R)-N-tert-butyl-3-methyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide Traditional Name: (3R)-N-tert-butyl-5-keto-3-methyl-5-(4-pyridin-1-ium-2-ylpiperazino)valeramide Formula: C19H31N4O2+ MolecularWeight: 347.47504

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC(C)(C)C)CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

C[C@H](CC(=O)NC(C)(C)C)CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C19H30N4O2/c1-15(13-17(24)21-19(2,3)4)14-18(25)23-11-9-22(10-12-23)16-7-5-6-8-20-16/h5-8,15H,9-14H2,1-4H3,(H,21,24)/p+1/t15-/m1/s1