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

Systemtic Name: [(2R)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-isopropyl-[(1R)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: [(2R)-1-oxo-1-(1-piperazinyl)propan-2-yl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(2R)-1-oxo-1-piperazin-1-ylpropan-2-yl]-propan-2-ylazanium Traditional Name: benzyl-isopropyl-[(1R)-2-keto-1-methyl-2-piperazino-ethyl]ammonium Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)C(C)C(=O)N2CCNCC2

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O/c1-14(2)20(13-16-7-5-4-6-8-16)15(3)17(21)19-11-9-18-10-12-19/h4-8,14-15,18H,9-13H2,1-3H3/p+1/t15-/m1/s1