[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate

Systemtic Name: [2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate Openeye Name: [2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl] ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C(=O)OCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O5/c1-3-21(30-20-7-5-4-6-8-20)23(27)29-17-22(26)25-15-13-24(14-16-25)18-9-11-19(28-2)12-10-18/h4-12,21H,3,13-17H2,1-2H3/t21-/m1/s1