tert-butyl 10-phenyl-2-[2-pyridin-3-yl-5-(trifluoromethyloxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate

Systemtic Name: tert-butyl 10-phenyl-2-[2-pyridin-3-yl-5-(trifluoromethyloxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate Openeye Name: tert-butyl 10-phenyl-2-[2-(3-pyridyl)-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate CAS Name: 10-phenyl-2-[2-(3-pyridinyl)-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 10-phenyl-2-[2-pyridin-3-yl-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate Traditional Name: 10-phenyl-2-[2-(3-pyridyl)-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylic acid tert-butyl ester Formula: C31H33F3N2O4 MolecularWeight: 554.59993

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC2(C1C3=CC=CC=C3)CC(CO2)C4=C(C=CC(=C4)OC(F)(F)F)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC2(C1C3=CC=CC=C3)CC(CO2)C4=C(C=CC(=C4)OC(F)(F)F)C5=CN=CC=C5

InChI

InChI=1S/C31H33F3N2O4/c1-29(2,3)40-28(37)36-16-8-14-30(27(36)21-9-5-4-6-10-21)18-23(20-38-30)26-17-24(39-31(32,33)34)12-13-25(26)22-11-7-15-35-19-22/h4-7,9-13,15,17,19,23,27H,8,14,16,18,20H2,1-3H3