ethyl (5S,6S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanyl-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: ethyl (5S,6S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanyl-cyclohexa-1,3-diene-1-carboxylate Openeye Name: ethyl (5S,6S)-6-(tert-butoxycarbonylamino)-5-hydroxy-cyclohexa-1,3-diene-1-carboxylate CAS Name: (5S,6S)-5-hydroxy-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester IUPAC Name: ethyl (5S,6S)-5-hydroxy-6-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,3-diene-1-carboxylate Traditional Name: (5S,6S)-6-(tert-butoxycarbonylamino)-5-hydroxy-cyclohexa-1,3-diene-1-carboxylic acid ethyl ester Formula: C14H21NO5 MolecularWeight: 283.32024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(C1NC(=O)OC(C)(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C[C@@H]([C@H]1NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C14H21NO5/c1-5-19-12(17)9-7-6-8-10(16)11(9)15-13(18)20-14(2,3)4/h6-8,10-11,16H,5H2,1-4H3,(H,15,18)/t10-,11-/m0/s1