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

Systemtic Name: tert-butyl 10-phenyl-2-[2-pyridin-4-yl-5-(trifluoromethyloxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate Openeye Name: tert-butyl 10-phenyl-2-[2-(4-pyridyl)-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate CAS Name: 10-phenyl-2-[2-pyridin-4-yl-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-4-yl-5-(trifluoromethoxy)phenyl]-4-oxa-9-azaspiro[4.5]decane-9-carboxylate Traditional Name: 10-phenyl-2-[2-(4-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=CC=NC=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=CC=NC=C5

InChI

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