1-(1-adamantylcarbonyl)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-(4-ethoxy-3-methoxy-benzyl)pyrrolidine-2-carboxamide Formula: C26H36N2O4 MolecularWeight: 440.57504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C26H36N2O4/c1-3-32-22-7-6-17(12-23(22)31-2)16-27-24(29)21-5-4-8-28(21)25(30)26-13-18-9-19(14-26)11-20(10-18)15-26/h6-7,12,18-21H,3-5,8-11,13-16H2,1-2H3,(H,27,29)