(2R,5R)-1-(phenylmethyl)-2,5-di(propan-2-yl)piperazin-4-ium

Systemtic Name: (2R,5R)-1-(phenylmethyl)-2,5-di(propan-2-yl)piperazin-4-ium Openeye Name: (2R,5R)-1-benzyl-2,5-diisopropyl-piperazin-4-ium CAS Name: (2R,5R)-1-(phenylmethyl)-2,5-di(propan-2-yl)piperazin-4-ium IUPAC Name: (2R,5R)-1-benzyl-2,5-di(propan-2-yl)piperazin-4-ium Traditional Name: (2R,5R)-1-benzyl-2,5-diisopropyl-piperazin-4-ium Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C[NH2+]C(CN1CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CC(C)[C@@H]1C[NH2+][C@@H](CN1CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C17H28N2/c1-13(2)16-12-19(17(10-18-16)14(3)4)11-15-8-6-5-7-9-15/h5-9,13-14,16-18H,10-12H2,1-4H3/p+1/t16-,17-/m0/s1