methyl-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(1S)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: methyl-[(2S)-1-oxo-1-(1-piperazinyl)propan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]azanium Traditional Name: benzyl-[(1S)-2-keto-1-methyl-2-piperazino-ethyl]-methyl-ammonium Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C15H23N3O/c1-13(15(19)18-10-8-16-9-11-18)17(2)12-14-6-4-3-5-7-14/h3-7,13,16H,8-12H2,1-2H3/p+1/t13-/m0/s1