tert-butyl (2S,3R)-3-methyl-2-[(4-methylphenyl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R)-3-methyl-2-[(4-methylphenyl)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,3R)-3-methyl-2-(p-tolylmethyl)pyrrolidine-1-carboxylate CAS Name: (2S,3R)-3-methyl-2-[(4-methylphenyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-3-methyl-2-[(4-methylphenyl)methyl]pyrrolidine-1-carboxylate Traditional Name: (2S,3R)-3-methyl-2-(4-methylbenzyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1CC2=CC=C(C=C2)C)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H]1CCN([C@H]1CC2=CC=C(C=C2)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H27NO2/c1-13-6-8-15(9-7-13)12-16-14(2)10-11-19(16)17(20)21-18(3,4)5/h6-9,14,16H,10-12H2,1-5H3/t14-,16+/m1/s1