1-(1-adamantylcarbonyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-veratryl-pyrrolidine-2-carboxamide Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C25H34N2O4/c1-30-21-6-5-16(11-22(21)31-2)15-26-23(28)20-4-3-7-27(20)24(29)25-12-17-8-18(13-25)10-19(9-17)14-25/h5-6,11,17-20H,3-4,7-10,12-15H2,1-2H3,(H,26,28)