1-benzofuran-2-yl-[4-[3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-[3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-[3-(4-tert-butylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[4-[3-(4-tert-butylphenoxy)-2-hydroxypropyl]-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-[3-(4-tert-butylphenoxy)-2-hydroxypropyl]piperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-[3-(4-tert-butylphenoxy)-2-hydroxy-propyl]piperazino]methanone Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3)O

InChI

InChI=1S/C26H32N2O4/c1-26(2,3)20-8-10-22(11-9-20)31-18-21(29)17-27-12-14-28(15-13-27)25(30)24-16-19-6-4-5-7-23(19)32-24/h4-11,16,21,29H,12-15,17-18H2,1-3H3