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

Systemtic Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]pentyl]azanium Openeye Name: [(2R)-2-methyl-2-[4-(m-tolyl)piperazin-1-ium-1-yl]pentyl]ammonium CAS Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]pentyl]ammonium IUPAC Name: [(2R)-2-methyl-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]pentyl]azanium Traditional Name: [(2R)-2-methyl-2-[4-(m-tolyl)piperazin-1-ium-1-yl]pentyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3/c1-4-8-17(3,14-18)20-11-9-19(10-12-20)16-7-5-6-15(2)13-16/h5-7,13H,4,8-12,14,18H2,1-3H3/p+2/t17-/m1/s1