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

Systemtic Name: 2-methylpropyl (2S,4R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: isobutyl (2S,4R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-[[4-(1-adamantyl)anilino]-oxomethyl]-4-hydroxy-1-pyrrolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S,4R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-[[4-(1-adamantyl)phenyl]carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylic acid isobutyl ester Formula: C26H36N2O4 MolecularWeight: 440.57504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CC(CC1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC(C)COC(=O)N1C[C@@H](C[C@H]1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C26H36N2O4/c1-16(2)15-32-25(31)28-14-22(29)10-23(28)24(30)27-21-5-3-20(4-6-21)26-11-17-7-18(12-26)9-19(8-17)13-26/h3-6,16-19,22-23,29H,7-15H2,1-2H3,(H,27,30)/t17?,18?,19?,22-,23+,26?/m1/s1