methyl (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetate CAS Name: (2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenylacetate Traditional Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetic acid methyl ester Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H24N2O3/c1-24-18-11-7-6-10-17(18)21-12-14-22(15-13-21)19(20(23)25-2)16-8-4-3-5-9-16/h3-11,19H,12-15H2,1-2H3/p+1/t19-/m1/s1