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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[NH3+])N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C[NH3+])N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O/c1-24-19-9-7-18(8-10-19)20(15-21)23-13-11-22(12-14-23)16-17-5-3-2-4-6-17/h2-10,20H,11-16,21H2,1H3/p+2/t20-/m0/s1