3-bromanyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: 3-bromanyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide Openeye Name: 3-bromo-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide CAS Name: 3-bromo-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3-bromo-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide Traditional Name: 3-bromo-N-[2-(pyrrolidinomethyl)benzyl]adamantane-1-carboxamide Formula: C23H31BrN2O MolecularWeight: 431.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=O)C34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=O)C34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C23H31BrN2O/c24-23-12-17-9-18(13-23)11-22(10-17,16-23)21(27)25-14-19-5-1-2-6-20(19)15-26-7-3-4-8-26/h1-2,5-6,17-18H,3-4,7-16H2,(H,25,27)