[(2S)-3-methyl-1-[4-(2-methylprop-2-enyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-[4-(2-methylprop-2-enyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-[4-(2-methylallyl)piperazine-1-carbonyl]propyl]ammonium CAS Name: [(2S)-3-methyl-1-[4-(2-methylprop-2-enyl)-1-piperazinyl]-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-3-methyl-1-[4-(2-methylprop-2-enyl)piperazin-1-yl]-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-[4-(2-methylallyl)piperazine-1-carbonyl]propyl]ammonium Formula: C13H26N3O+ MolecularWeight: 240.36504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H25N3O/c1-10(2)9-15-5-7-16(8-6-15)13(17)12(14)11(3)4/h11-12H,1,5-9,14H2,2-4H3/p+1/t12-/m0/s1