N-[[4-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[[2-phenyl-2-(1-pyrrolidinyl)ethyl]amino]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[(2-phenyl-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[(2-phenyl-2-pyrrolidino-ethyl)carbamoyl]benzyl]adamantane-1-carboxamide Formula: C31H39N3O2 MolecularWeight: 485.66026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C31H39N3O2/c35-29(32-21-28(34-12-4-5-13-34)26-6-2-1-3-7-26)27-10-8-22(9-11-27)20-33-30(36)31-17-23-14-24(18-31)16-25(15-23)19-31/h1-3,6-11,23-25,28H,4-5,12-21H2,(H,32,35)(H,33,36)