(4-methylphenyl)methyl (2S,4R)-1-(1-adamantylcarbonyl)-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl (2S,4R)-1-(1-adamantylcarbonyl)-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: p-tolylmethyl (2S,4R)-1-(adamantane-1-carbonyl)-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[1-adamantyl(oxo)methyl]-4-hydroxy-2-pyrrolidinecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl (2S,4R)-1-(adamantane-1-carbonyl)-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(adamantane-1-carbonyl)-4-hydroxy-pyrrolidine-2-carboxylic acid (4-methylbenzyl) ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2CC(CN2C(=O)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)[C@@H]2C[C@H](CN2C(=O)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C24H31NO4/c1-15-2-4-16(5-3-15)14-29-22(27)21-9-20(26)13-25(21)23(28)24-10-17-6-18(11-24)8-19(7-17)12-24/h2-5,17-21,26H,6-14H2,1H3/t17?,18?,19?,20-,21+,24?/m1/s1