[(2R)-1-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-3,3-dimethyl-butan-2-yl]azanium

Systemtic Name: [(2R)-1-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-3,3-dimethyl-butan-2-yl]azanium Openeye Name: [(1R)-1-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2,2-dimethyl-propyl]ammonium CAS Name: [(2R)-1-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-3,3-dimethylbutan-2-yl]ammonium IUPAC Name: [(2R)-1-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-3,3-dimethylbutan-2-yl]azanium Traditional Name: [(1R)-1-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2,2-dimethyl-propyl]ammonium Formula: C17H31N3O+2 MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C[NH+]1CCN(CC1)C2=CC(=CC=C2)OC)[NH3+]

Isomeric SMILES

CC(C)(C)[C@H](C[NH+]1CCN(CC1)C2=CC(=CC=C2)OC)[NH3+]

InChI

InChI=1S/C17H29N3O/c1-17(2,3)16(18)13-19-8-10-20(11-9-19)14-6-5-7-15(12-14)21-4/h5-7,12,16H,8-11,13,18H2,1-4H3/p+2/t16-/m0/s1