tert-butyl (3S,5R)-3-(isoquinolin-4-ylmethyl)-5-methyl-1,2-oxazolidine-2-carboxylate

Systemtic Name: tert-butyl (3S,5R)-3-(isoquinolin-4-ylmethyl)-5-methyl-1,2-oxazolidine-2-carboxylate Openeye Name: tert-butyl (3S,5R)-3-(4-isoquinolylmethyl)-5-methyl-isoxazolidine-2-carboxylate CAS Name: (3S,5R)-3-(4-isoquinolinylmethyl)-5-methyl-2-isoxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,5R)-3-(isoquinolin-4-ylmethyl)-5-methyl-1,2-oxazolidine-2-carboxylate Traditional Name: (3S,5R)-3-(4-isoquinolylmethyl)-5-methyl-isoxazolidine-2-carboxylic acid tert-butyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(O1)C(=O)OC(C)(C)C)CC2=CN=CC3=CC=CC=C32

Isomeric SMILES

C[C@@H]1C[C@@H](N(O1)C(=O)OC(C)(C)C)CC2=CN=CC3=CC=CC=C32

InChI

InChI=1S/C19H24N2O3/c1-13-9-16(21(24-13)18(22)23-19(2,3)4)10-15-12-20-11-14-7-5-6-8-17(14)15/h5-8,11-13,16H,9-10H2,1-4H3/t13-,16-/m1/s1