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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC(CC(C)C)[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)C[C@@H](CC(C)C)[NH3+]

InChI

InChI=1S/C17H29N3/c1-14(2)11-16(18)13-19-7-9-20(10-8-19)17-6-4-5-15(3)12-17/h4-6,12,14,16H,7-11,13,18H2,1-3H3/p+2/t16-/m1/s1