[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(4-methylphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(4-methylphenyl)ethyl]azanium Openeye Name: [(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(p-tolyl)ethyl]ammonium CAS Name: [(2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-(4-methylphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(4-methylphenyl)ethyl]azanium Traditional Name: [(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(p-tolyl)ethyl]ammonium Formula: C20H29N3O+2 MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH3+])[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH3+])[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C20H27N3O/c1-16-7-9-17(10-8-16)19(15-21)23-13-11-22(12-14-23)18-5-3-4-6-20(18)24-2/h3-10,19H,11-15,21H2,1-2H3/p+2/t19-/m0/s1