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

Systemtic Name: [(2S)-1-[4-(2-methylprop-2-enyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[4-(2-methylallyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(2-methylprop-2-enyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2-methylprop-2-enyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-[4-(2-methylallyl)piperazino]ethyl]ammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC(=C)CN1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C17H25N3O/c1-14(2)13-19-8-10-20(11-9-19)17(21)16(18)12-15-6-4-3-5-7-15/h3-7,16H,1,8-13,18H2,2H3/p+1/t16-/m0/s1