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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3/c1-13(2)16(12-17)19-9-7-18(8-10-19)15-6-4-5-14(3)11-15/h4-6,11,13,16H,7-10,12,17H2,1-3H3/p+2/t16-/m0/s1