[(2S)-4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium

Systemtic Name: [(2S)-4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium Openeye Name: [(1S)-1-methyl-3-[4-(m-tolyl)piperazin-1-ium-1-yl]propyl]ammonium CAS Name: [(2S)-4-[4-(3-methylphenyl)-1-piperazin-1-iumyl]butan-2-yl]ammonium IUPAC Name: [(2S)-4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium Traditional Name: [(1S)-1-methyl-3-[4-(m-tolyl)piperazin-1-ium-1-yl]propyl]ammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3/c1-13-4-3-5-15(12-13)18-10-8-17(9-11-18)7-6-14(2)16/h3-5,12,14H,6-11,16H2,1-2H3/p+2/t14-/m0/s1