[(2S)-1-[4-(4-aminophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-1-[4-(4-aminophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-2-[4-(4-aminophenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [(2S)-1-[4-(4-aminophenyl)-1-piperazinyl]-1-oxopropan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-[4-(4-aminophenyl)piperazin-1-yl]-1-oxopropan-2-yl]-dimethylazanium Traditional Name: [(1S)-2-[4-(4-aminophenyl)piperazino]-2-keto-1-methyl-ethyl]-dimethyl-ammonium Formula: C15H25N4O+ MolecularWeight: 277.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N4O/c1-12(17(2)3)15(20)19-10-8-18(9-11-19)14-6-4-13(16)5-7-14/h4-7,12H,8-11,16H2,1-3H3/p+1/t12-/m0/s1