(1R,4R,5S,6S,7R,8R)-7-(hydroxymethyl)-8-[(2-methylpropan-2-yl)oxy]-4-(2-nitrophenyl)bicyclo[3.2.1]oct-2-en-6-ol

Systemtic Name: (1R,4R,5S,6S,7R,8R)-7-(hydroxymethyl)-8-[(2-methylpropan-2-yl)oxy]-4-(2-nitrophenyl)bicyclo[3.2.1]oct-2-en-6-ol Openeye Name: (1R,4R,5S,6S,7R,8R)-8-tert-butoxy-7-(hydroxymethyl)-4-(2-nitrophenyl)bicyclo[3.2.1]oct-2-en-6-ol CAS Name: (1R,4R,5S,6S,7R,8R)-7-(hydroxymethyl)-8-[(2-methylpropan-2-yl)oxy]-4-(2-nitrophenyl)-6-bicyclo[3.2.1]oct-2-enol IUPAC Name: (1R,4R,5S,6S,7R,8R)-7-(hydroxymethyl)-8-[(2-methylpropan-2-yl)oxy]-4-(2-nitrophenyl)bicyclo[3.2.1]oct-2-en-6-ol Traditional Name: (1R,4R,5S,6S,7R,8R)-8-tert-butoxy-7-methylol-4-(2-nitrophenyl)bicyclo[3.2.1]oct-2-en-6-ol Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1C2C=CC(C1C(C2CO)O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)O[C@@H]1[C@@H]2C=C[C@H]([C@H]1[C@H]([C@H]2CO)O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H25NO5/c1-19(2,3)25-18-13-9-8-12(16(18)17(22)14(13)10-21)11-6-4-5-7-15(11)20(23)24/h4-9,12-14,16-18,21-22H,10H2,1-3H3/t12-,13+,14-,16-,17-,18+/m0/s1