(2R)-N-(5-acetamido-2-methoxy-phenyl)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(5-acetamido-2-methoxy-phenyl)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(5-acetamido-2-methoxy-phenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(5-acetamido-2-methoxyphenyl)-1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(5-acetamido-2-methoxyphenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(5-acetamido-2-methoxy-phenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)[C@H]2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O4/c1-15(29)26-19-5-6-22(32-2)20(11-19)27-23(30)21-4-3-7-28(21)24(31)25-12-16-8-17(13-25)10-18(9-16)14-25/h5-6,11,16-18,21H,3-4,7-10,12-14H2,1-2H3,(H,26,29)(H,27,30)/t16?,17?,18?,21-,25?/m1/s1