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

Systemtic Name: (2R,5R)-5-(2-methylpropyl)-1-(phenylmethyl)-2-propan-2-yl-piperazin-4-ium Openeye Name: (2R,5R)-1-benzyl-5-isobutyl-2-isopropyl-piperazin-4-ium CAS Name: (2R,5R)-5-(2-methylpropyl)-1-(phenylmethyl)-2-propan-2-ylpiperazin-4-ium IUPAC Name: (2R,5R)-1-benzyl-5-(2-methylpropyl)-2-propan-2-ylpiperazin-4-ium Traditional Name: (2R,5R)-1-benzyl-5-isobutyl-2-isopropyl-piperazin-4-ium Formula: C18H31N2+ MolecularWeight: 275.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CN(C(C[NH2+]1)C(C)C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H]1CN([C@@H](C[NH2+]1)C(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C18H30N2/c1-14(2)10-17-13-20(18(11-19-17)15(3)4)12-16-8-6-5-7-9-16/h5-9,14-15,17-19H,10-13H2,1-4H3/p+1/t17-,18+/m1/s1