ethyl (1S,2R,5S)-2-(hydroxymethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,2R,5S)-2-(hydroxymethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,2R,5S)-5-(tert-butoxycarbonylamino)-2-hydroxy-2-(hydroxymethyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,2R,5S)-2-hydroxy-2-(hydroxymethyl)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R,5S)-2-hydroxy-2-(hydroxymethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,2R,5S)-5-(tert-butoxycarbonylamino)-2-hydroxy-2-methylol-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C15H25NO6 MolecularWeight: 315.3621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C=CC1(CO)O)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO6/c1-5-21-12(18)11-8-10(6-7-15(11,20)9-17)16-13(19)22-14(2,3)4/h6-7,10-11,17,20H,5,8-9H2,1-4H3,(H,16,19)/t10-,11-,15+/m1/s1