3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one

Systemtic Name: 3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one Openeye Name: 3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one CAS Name: 3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one IUPAC Name: 3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one Traditional Name: 3-hexyl-6-[3-(1H-imidazol-2-yl)phenyl]-6-methyl-3-azabicyclo[3.1.0]hexan-4-one Formula: C21H27N3O MolecularWeight: 337.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CC2C(C1=O)C2(C)C3=CC=CC(=C3)C4=NC=CN4

Isomeric SMILES

CCCCCCN1CC2C(C1=O)C2(C)C3=CC=CC(=C3)C4=NC=CN4

InChI

InChI=1S/C21H27N3O/c1-3-4-5-6-12-24-14-17-18(20(24)25)21(17,2)16-9-7-8-15(13-16)19-22-10-11-23-19/h7-11,13,17-18H,3-6,12,14H2,1-2H3,(H,22,23)