(2R,5R)-2,5-bis(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium

Systemtic Name: (2R,5R)-2,5-bis(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium Openeye Name: (2R,5R)-1-benzyl-2,5-diisobutyl-piperazin-4-ium CAS Name: (2R,5R)-2,5-bis(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium IUPAC Name: (2R,5R)-1-benzyl-2,5-bis(2-methylpropyl)piperazin-4-ium Traditional Name: (2R,5R)-1-benzyl-2,5-diisobutyl-piperazin-4-ium Formula: C19H33N2+ MolecularWeight: 289.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C[NH2+]C(CN1CC2=CC=CC=C2)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H32N2/c1-15(2)10-18-14-21(13-17-8-6-5-7-9-17)19(12-20-18)11-16(3)4/h5-9,15-16,18-20H,10-14H2,1-4H3/p+1/t18-,19-/m1/s1