tert-butyl (3R,6S)-3-butyl-5-methyl-6-(phenylmethoxymethyl)-3,6-dihydro-1,2-oxazine-2-carboxylate

Systemtic Name: tert-butyl (3R,6S)-3-butyl-5-methyl-6-(phenylmethoxymethyl)-3,6-dihydro-1,2-oxazine-2-carboxylate Openeye Name: tert-butyl (3R,6S)-6-(benzyloxymethyl)-3-butyl-5-methyl-3,6-dihydrooxazine-2-carboxylate CAS Name: (3R,6S)-3-butyl-5-methyl-6-(phenylmethoxymethyl)-3,6-dihydrooxazine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R,6S)-3-butyl-5-methyl-6-(phenylmethoxymethyl)-3,6-dihydrooxazine-2-carboxylate Traditional Name: (3R,6S)-6-(benzoxymethyl)-3-butyl-5-methyl-3,6-dihydrooxazine-2-carboxylic acid tert-butyl ester Formula: C22H33NO4 MolecularWeight: 375.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=C(C(ON1C(=O)OC(C)(C)C)COCC2=CC=CC=C2)C

Isomeric SMILES

CCCC[C@@H]1C=C([C@H](ON1C(=O)OC(C)(C)C)COCC2=CC=CC=C2)C

InChI

InChI=1S/C22H33NO4/c1-6-7-13-19-14-17(2)20(16-25-15-18-11-9-8-10-12-18)27-23(19)21(24)26-22(3,4)5/h8-12,14,19-20H,6-7,13,15-16H2,1-5H3/t19-,20-/m1/s1