(Z)-6-[(2R,3aS,7S)-2-phenyl-7-(phenylmethoxymethoxymethyl)-2,3,4,5,6,7-hexahydro-[1,2]oxazolo[2,3-a]pyridin-3a-yl]hex-2-enenitrile

Systemtic Name: (Z)-6-[(2R,3aS,7S)-2-phenyl-7-(phenylmethoxymethoxymethyl)-2,3,4,5,6,7-hexahydro-[1,2]oxazolo[2,3-a]pyridin-3a-yl]hex-2-enenitrile Openeye Name: (Z)-6-[(2R,3aS,7S)-7-(benzyloxymethoxymethyl)-2-phenyl-2,3,4,5,6,7-hexahydroisoxazolo[2,3-a]pyridin-3a-yl]hex-2-enenitrile CAS Name: (Z)-6-[(2R,3aS,7S)-2-phenyl-7-(phenylmethoxymethoxymethyl)-2,3,4,5,6,7-hexahydroisoxazolo[2,3-a]pyridin-3a-yl]-2-hexenenitrile IUPAC Name: (Z)-6-[(2R,3aS,7S)-2-phenyl-7-(phenylmethoxymethoxymethyl)-2,3,4,5,6,7-hexahydro-[1,2]oxazolo[2,3-a]pyridin-3a-yl]hex-2-enenitrile Traditional Name: (Z)-6-[(2R,3aS,7S)-7-(benzoxymethoxymethyl)-2-phenyl-2,3,4,5,6,7-hexahydroisoxazolo[2,3-a]pyridin-3a-yl]hex-2-enenitrile Formula: C28H34N2O3 MolecularWeight: 446.58116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N2C(C1)(CC(O2)C3=CC=CC=C3)CCCC=CC#N)COCOCC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N2[C@@](C1)(C[C@@H](O2)C3=CC=CC=C3)CCC/C=C\C#N)COCOCC4=CC=CC=C4

InChI

InChI=1S/C28H34N2O3/c29-19-10-2-1-9-17-28-18-11-16-26(22-32-23-31-21-24-12-5-3-6-13-24)30(28)33-27(20-28)25-14-7-4-8-15-25/h2-8,10,12-15,26-27H,1,9,11,16-18,20-23H2/b10-2-/t26-,27+,28-/m0/s1