ethyl 4-[3-[4-[3-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[4-[3-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[4-[3-(4-ethoxycarbonylpiperazin-1-yl)-2-hydroxy-propoxy]phenoxy]-2-hydroxy-propyl]piperazine-1-carboxylate CAS Name: 4-[3-[4-[3-(4-ethoxycarbonyl-1-piperazinyl)-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-[3-(4-ethoxycarbonylpiperazin-1-yl)-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-[3-(4-carbethoxypiperazino)-2-hydroxy-propoxy]phenoxy]-2-hydroxy-propyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H42N4O8 MolecularWeight: 538.63368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(COC2=CC=C(C=C2)OCC(CN3CCN(CC3)C(=O)OCC)O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(COC2=CC=C(C=C2)OCC(CN3CCN(CC3)C(=O)OCC)O)O

InChI

InChI=1S/C26H42N4O8/c1-3-35-25(33)29-13-9-27(10-14-29)17-21(31)19-37-23-5-7-24(8-6-23)38-20-22(32)18-28-11-15-30(16-12-28)26(34)36-4-2/h5-8,21-22,31-32H,3-4,9-20H2,1-2H3