tert-butyl (2R,3S,6S)-3-methyl-6-(phenylmethoxymethyl)-1,2,3,6-tetrahydropyridine-2-carboxylate

Systemtic Name: tert-butyl (2R,3S,6S)-3-methyl-6-(phenylmethoxymethyl)-1,2,3,6-tetrahydropyridine-2-carboxylate Openeye Name: tert-butyl (2R,3S,6S)-6-(benzyloxymethyl)-3-methyl-1,2,3,6-tetrahydropyridine-2-carboxylate CAS Name: (2R,3S,6S)-3-methyl-6-(phenylmethoxymethyl)-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S,6S)-3-methyl-6-(phenylmethoxymethyl)-1,2,3,6-tetrahydropyridine-2-carboxylate Traditional Name: (2R,3S,6S)-6-(benzoxymethyl)-3-methyl-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(NC1C(=O)OC(C)(C)C)COCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1C=C[C@H](N[C@H]1C(=O)OC(C)(C)C)COCC2=CC=CC=C2

InChI

InChI=1S/C19H27NO3/c1-14-10-11-16(13-22-12-15-8-6-5-7-9-15)20-17(14)18(21)23-19(2,3)4/h5-11,14,16-17,20H,12-13H2,1-4H3/t14-,16-,17+/m0/s1