N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidine-1-carboxamide Openeye Name: N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidine-1-carboxamide CAS Name: N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)-1-pyrrolidinecarboxamide IUPAC Name: N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidine-1-carboxamide Traditional Name: N-(1-adamantyl)-2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidine-1-carboxamide Formula: C28H31N3O2 MolecularWeight: 441.56464

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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=CC=C7

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O2/c32-27(30-28-15-18-11-19(16-28)13-20(12-18)17-28)31-10-4-7-24(31)26-29-23-14-22(8-9-25(23)33-26)21-5-2-1-3-6-21/h1-3,5-6,8-9,14,18-20,24H,4,7,10-13,15-17H2,(H,30,32)