diethyl 4-[2-(5-cyano-2-phenylmethoxy-phenoxy)-3,5-bis(fluoranyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]oxycyclopentane-1,2-dicarboxylate

Systemtic Name: diethyl 4-[2-(5-cyano-2-phenylmethoxy-phenoxy)-3,5-bis(fluoranyl)-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]oxycyclopentane-1,2-dicarboxylate Openeye Name: diethyl 4-[[2-(2-benzyloxy-5-cyano-phenoxy)-3,5-difluoro-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-4-pyridyl]oxy]cyclopentane-1,2-dicarboxylate CAS Name: 4-[[2-(5-cyano-2-phenylmethoxyphenoxy)-3,5-difluoro-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-4-pyridinyl]oxy]cyclopentane-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[2-(5-cyano-2-phenylmethoxyphenoxy)-3,5-difluoro-6-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]pyridin-4-yl]oxycyclopentane-1,2-dicarboxylate Traditional Name: 4-[[2-(2-benzoxy-5-cyano-phenoxy)-3,5-difluoro-6-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-4-pyridyl]oxy]cyclopentane-1,2-dicarboxylic acid diethyl ester Formula: C40H38F2N4O8 MolecularWeight: 740.748526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CC1C(=O)OCC)OC2=C(C(=NC(=C2F)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4)OC5=CC=CC(=C5)C6=NCCN6C)F

Isomeric SMILES

CCOC(=O)C1CC(CC1C(=O)OCC)OC2=C(C(=NC(=C2F)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4)OC5=CC=CC(=C5)C6=NCCN6C)F

InChI

InChI=1S/C40H38F2N4O8/c1-4-49-39(47)29-20-28(21-30(29)40(48)50-5-2)52-35-33(41)37(53-27-13-9-12-26(19-27)36-44-16-17-46(36)3)45-38(34(35)42)54-32-18-25(22-43)14-15-31(32)51-23-24-10-7-6-8-11-24/h6-15,18-19,28-30H,4-5,16-17,20-21,23H2,1-3H3