methyl 4-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[2-hydroxy-3-[4-(2-hydroxyphenyl)piperazin-1-yl]propoxy]benzoate CAS Name: 4-[2-hydroxy-3-[4-(2-hydroxyphenyl)-1-piperazinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-hydroxy-3-[4-(2-hydroxyphenyl)piperazin-1-yl]propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-[4-(2-hydroxyphenyl)piperazino]propoxy]benzoic acid methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3O)O

InChI

InChI=1S/C21H26N2O5/c1-27-21(26)16-6-8-18(9-7-16)28-15-17(24)14-22-10-12-23(13-11-22)19-4-2-3-5-20(19)25/h2-9,17,24-25H,10-15H2,1H3