tert-butyl (5S,6S)-6-methyl-2-(4-nitrophenyl)-3-(phenylmethyl)-1,3-oxazinane-5-carboxylate

Systemtic Name: tert-butyl (5S,6S)-6-methyl-2-(4-nitrophenyl)-3-(phenylmethyl)-1,3-oxazinane-5-carboxylate Openeye Name: tert-butyl (5S,6S)-3-benzyl-6-methyl-2-(4-nitrophenyl)-1,3-oxazinane-5-carboxylate CAS Name: (5S,6S)-6-methyl-2-(4-nitrophenyl)-3-(phenylmethyl)-1,3-oxazinane-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (5S,6S)-3-benzyl-6-methyl-2-(4-nitrophenyl)-1,3-oxazinane-5-carboxylate Traditional Name: (5S,6S)-3-benzyl-6-methyl-2-(4-nitrophenyl)-1,3-oxazinane-5-carboxylic acid tert-butyl ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN(C(O1)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]1[C@H](CN(C(O1)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H28N2O5/c1-16-20(22(26)30-23(2,3)4)15-24(14-17-8-6-5-7-9-17)21(29-16)18-10-12-19(13-11-18)25(27)28/h5-13,16,20-21H,14-15H2,1-4H3/t16-,20-,21?/m0/s1