[(2S)-1-oxidanylidene-3-phenyl-1-(4-prop-2-enylpiperazin-1-yl)propan-2-yl]azanium

Systemtic Name: [(2S)-1-oxidanylidene-3-phenyl-1-(4-prop-2-enylpiperazin-1-yl)propan-2-yl]azanium Openeye Name: [(1S)-2-(4-allylpiperazin-1-yl)-1-benzyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-oxo-3-phenyl-1-(4-prop-2-enyl-1-piperazinyl)propan-2-yl]ammonium IUPAC Name: [(2S)-1-oxo-3-phenyl-1-(4-prop-2-enylpiperazin-1-yl)propan-2-yl]azanium Traditional Name: [(1S)-2-(4-allylpiperazino)-1-benzyl-2-keto-ethyl]ammonium Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C=CCN1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C16H23N3O/c1-2-8-18-9-11-19(12-10-18)16(20)15(17)13-14-6-4-3-5-7-14/h2-7,15H,1,8-13,17H2/p+1/t15-/m0/s1