3-[[2-[[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol

Systemtic Name: 3-[[2-[[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol Openeye Name: 3-[[2-[[1-[(3,5-diethoxy-4-fluoro-phenyl)methyl]-4-piperidyl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol CAS Name: 3-[[2-[[1-[(3,5-diethoxy-4-fluorophenyl)methyl]-4-piperidinyl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol IUPAC Name: 3-[[2-[[1-[(3,5-diethoxy-4-fluorophenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol Traditional Name: 3-[[2-[[1-(3,5-diethoxy-4-fluoro-benzyl)-4-piperidyl]amino]-1,3-benzoxazol-5-yl]oxy]propane-1,2-diol Formula: C26H34FN3O6 MolecularWeight: 503.563063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC4=C(O3)C=CC(=C4)OCC(CO)O

Isomeric SMILES

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC4=C(O3)C=CC(=C4)OCC(CO)O

InChI

InChI=1S/C26H34FN3O6/c1-3-33-23-11-17(12-24(25(23)27)34-4-2)14-30-9-7-18(8-10-30)28-26-29-21-13-20(5-6-22(21)36-26)35-16-19(32)15-31/h5-6,11-13,18-19,31-32H,3-4,7-10,14-16H2,1-2H3,(H,28,29)