2-methylpropyl (2R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: 2-methylpropyl (2R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: isobutyl (2R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[[4-(1-adamantyl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid isobutyl ester Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)COC(=O)N1CCC[C@@H]1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H36N2O3/c1-17(2)16-31-25(30)28-9-3-4-23(28)24(29)27-22-7-5-21(6-8-22)26-13-18-10-19(14-26)12-20(11-18)15-26/h5-8,17-20,23H,3-4,9-16H2,1-2H3,(H,27,29)/t18?,19?,20?,23-,26?/m1/s1