N-(1,3-benzodioxol-5-ylmethyl)-4-fluoranyl-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-fluoranyl-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-fluoro-N-[(3-phenyl-5-pyrrolidin-1-yl-isoxazol-4-yl)methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-fluoro-N-[[3-phenyl-5-(1-pyrrolidinyl)-4-isoxazolyl]methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-fluoro-N-[(3-phenyl-5-pyrrolidin-1-yl-1,2-oxazol-4-yl)methyl]benzamide Traditional Name: 4-fluoro-N-[(3-phenyl-5-pyrrolidino-isoxazol-4-yl)methyl]-N-piperonyl-benzamide Formula: C29H26FN3O4 MolecularWeight: 499.532843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NO2)C3=CC=CC=C3)CN(CC4=CC5=C(C=C4)OCO5)C(=O)C6=CC=C(C=C6)F

Isomeric SMILES

C1CCN(C1)C2=C(C(=NO2)C3=CC=CC=C3)CN(CC4=CC5=C(C=C4)OCO5)C(=O)C6=CC=C(C=C6)F

InChI

InChI=1S/C29H26FN3O4/c30-23-11-9-22(10-12-23)28(34)33(17-20-8-13-25-26(16-20)36-19-35-25)18-24-27(21-6-2-1-3-7-21)31-37-29(24)32-14-4-5-15-32/h1-3,6-13,16H,4-5,14-15,17-19H2