N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Openeye Name: N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide CAS Name: N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide IUPAC Name: N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Traditional Name: N-(1-adamantyl)-2-[5-(4-fluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Formula: C28H30FN3O2 MolecularWeight: 459.555103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC23CC4CC(C2)CC(C4)C3)C5=NC6=C(O5)C=CC(=C6)C7=CC=C(C=C7)F

Isomeric SMILES

C1CC(N(C1)C(=O)NC23CC4CC(C2)CC(C4)C3)C5=NC6=C(O5)C=CC(=C6)C7=CC=C(C=C7)F

InChI

InChI=1S/C28H30FN3O2/c29-22-6-3-20(4-7-22)21-5-8-25-23(13-21)30-26(34-25)24-2-1-9-32(24)27(33)31-28-14-17-10-18(15-28)12-19(11-17)16-28/h3-8,13,17-19,24H,1-2,9-12,14-16H2,(H,31,33)