(3aS,5S,9aS)-5-(4-phenylphenyl)-2-(pyridin-3-ylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one

Systemtic Name: (3aS,5S,9aS)-5-(4-phenylphenyl)-2-(pyridin-3-ylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one Openeye Name: (3aS,5S,9aS)-5-(4-phenylphenyl)-2-(3-pyridylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one CAS Name: (3aS,5S,9aS)-5-(4-phenylphenyl)-2-(3-pyridinylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one IUPAC Name: (3aS,5S,9aS)-5-(4-phenylphenyl)-2-(pyridin-3-ylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one Traditional Name: (3aS,5S,9aS)-5-(4-phenylphenyl)-2-(3-pyridylmethyl)-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one Formula: C27H27N3O MolecularWeight: 409.52278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC23C(CC(N2C1)C4=CC=C(C=C4)C5=CC=CC=C5)CN(C3=O)CC6=CN=CC=C6

Isomeric SMILES

C1C[C@@]23[C@@H](C[C@H](N2C1)C4=CC=C(C=C4)C5=CC=CC=C5)CN(C3=O)CC6=CN=CC=C6

InChI

InChI=1S/C27H27N3O/c31-26-27-13-5-15-30(27)25(16-24(27)19-29(26)18-20-6-4-14-28-17-20)23-11-9-22(10-12-23)21-7-2-1-3-8-21/h1-4,6-12,14,17,24-25H,5,13,15-16,18-19H2/t24-,25-,27-/m0/s1