[(2R)-2-methyl-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]azanium

Systemtic Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]azanium Openeye Name: [(2R)-2-methyl-2-[4-(m-tolyl)piperazin-1-ium-1-yl]butyl]ammonium CAS Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]butyl]ammonium IUPAC Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]azanium Traditional Name: [(2R)-2-methyl-2-[4-(m-tolyl)piperazin-1-ium-1-yl]butyl]ammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3/c1-4-16(3,13-17)19-10-8-18(9-11-19)15-7-5-6-14(2)12-15/h5-7,12H,4,8-11,13,17H2,1-3H3/p+2/t16-/m1/s1