3-chloranyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[4-(pyrrolidinomethyl)benzyl]adamantane-1-carboxamide Formula: C23H31ClN2O MolecularWeight: 386.95804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C23H31ClN2O/c24-23-12-19-9-20(13-23)11-22(10-19,16-23)21(27)25-14-17-3-5-18(6-4-17)15-26-7-1-2-8-26/h3-6,19-20H,1-2,7-16H2,(H,25,27)