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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C(CC2(O1)CCCNC2C3=CC=CC=C3)C4=C(C=CC(=C4)OC(F)(F)F)C5=CN=CC=C5

Isomeric SMILES

CCCCOC(=O)C1C(CC2(O1)CCCNC2C3=CC=CC=C3)C4=C(C=CC(=C4)OC(F)(F)F)C5=CN=CC=C5

InChI

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