[(2S)-4-methyl-1-oxidanylidene-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentan-2-yl]azanium

Systemtic Name: [(2S)-4-methyl-1-oxidanylidene-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentan-2-yl]azanium Openeye Name: [(1S)-3-methyl-1-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)butyl]ammonium CAS Name: [(2S)-4-methyl-1-oxo-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentan-2-yl]ammonium IUPAC Name: [(2S)-4-methyl-1-oxo-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentan-2-yl]azanium Traditional Name: [(1S)-3-methyl-1-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)butyl]ammonium Formula: C15H26N4O+2 MolecularWeight: 278.39314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=CC=[NH+]2)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=[NH+]2)[NH3+]

InChI

InChI=1S/C15H24N4O/c1-12(2)11-13(16)15(20)19-9-7-18(8-10-19)14-5-3-4-6-17-14/h3-6,12-13H,7-11,16H2,1-2H3/p+2/t13-/m0/s1