[(2S)-1-(4-butanoylpiperazin-1-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(4-butanoylpiperazin-1-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-(4-butanoylpiperazine-1-carbonyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-4-methyl-1-oxo-1-[4-(1-oxobutyl)-1-piperazinyl]pentan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-butanoylpiperazin-1-yl)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-(4-butyrylpiperazine-1-carbonyl)-3-methyl-butyl]ammonium Formula: C14H28N3O2+ MolecularWeight: 270.39102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C(=O)C(CC(C)C)[NH3+]

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C(=O)[C@H](CC(C)C)[NH3+]

InChI

InChI=1S/C14H27N3O2/c1-4-5-13(18)16-6-8-17(9-7-16)14(19)12(15)10-11(2)3/h11-12H,4-10,15H2,1-3H3/p+1/t12-/m0/s1