ethyl 2-[(4E,5S,9S)-4-(cyanomethylidene)-10-[(1R)-2-oxidanyl-1-phenyl-ethyl]-10-azaspiro[4.5]decan-9-yl]ethanoate

Systemtic Name: ethyl 2-[(4E,5S,9S)-4-(cyanomethylidene)-10-[(1R)-2-oxidanyl-1-phenyl-ethyl]-10-azaspiro[4.5]decan-9-yl]ethanoate Openeye Name: ethyl 2-[(4E,5S,9S)-4-(cyanomethylene)-10-[(1R)-2-hydroxy-1-phenyl-ethyl]-10-azaspiro[4.5]decan-9-yl]acetate CAS Name: 2-[(4E,5S,9S)-4-(cyanomethylidene)-10-[(1R)-2-hydroxy-1-phenylethyl]-10-azaspiro[4.5]decan-9-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4E,5S,9S)-4-(cyanomethylidene)-10-[(1R)-2-hydroxy-1-phenylethyl]-10-azaspiro[4.5]decan-9-yl]acetate Traditional Name: 2-[(4E,5S,9S)-4-(cyanomethylene)-10-[(1R)-2-hydroxy-1-phenyl-ethyl]-10-azaspiro[4.5]decan-9-yl]acetic acid ethyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCC2(N1C(CO)C3=CC=CC=C3)CCCC2=CC#N

Isomeric SMILES

CCOC(=O)C[C@@H]1CCC[C@@]\2(N1[C@@H](CO)C3=CC=CC=C3)CCC/C2=C\C#N

InChI

InChI=1S/C23H30N2O3/c1-2-28-22(27)16-20-11-7-14-23(13-6-10-19(23)12-15-24)25(20)21(17-26)18-8-4-3-5-9-18/h3-5,8-9,12,20-21,26H,2,6-7,10-11,13-14,16-17H2,1H3/b19-12+/t20-,21-,23-/m0/s1