[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(4-methoxyphenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ammonium Formula: C14H26N3O+3 MolecularWeight: 252.37574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O/c1-16-7-9-17(10-8-16)14(11-15)12-3-5-13(18-2)6-4-12/h3-6,14H,7-11,15H2,1-2H3/p+3/t14-/m1/s1