ethyl 5-[(2R)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(2R)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(2R)-2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(2R)-2-hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2R)-2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(2R)-2-hydroxy-3-[4-(2-hydroxyethyl)piperazino]propoxy]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C26H32N2O6 MolecularWeight: 468.54208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(CN3CCN(CC3)CCO)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC[C@@H](CN3CCN(CC3)CCO)O)C4=CC=CC=C4

InChI

InChI=1S/C26H32N2O6/c1-2-32-26(31)24-22-16-21(8-9-23(22)34-25(24)19-6-4-3-5-7-19)33-18-20(30)17-28-12-10-27(11-13-28)14-15-29/h3-9,16,20,29-30H,2,10-15,17-18H2,1H3/t20-/m1/s1