(phenylmethyl) (1R,2R)-2-[(1R,4S,5S)-5-oxidanyl-4-bicyclo[2.1.1]hexanyl]cyclopropane-1-carboxylate

Systemtic Name: (phenylmethyl) (1R,2R)-2-[(1R,4S,5S)-5-oxidanyl-4-bicyclo[2.1.1]hexanyl]cyclopropane-1-carboxylate Openeye Name: benzyl (1R,2R)-2-[(1R,4S,5S)-5-hydroxy-4-bicyclo[2.1.1]hexanyl]cyclopropanecarboxylate CAS Name: (1R,2R)-2-[(1R,4S,5S)-5-hydroxy-4-bicyclo[2.1.1]hexanyl]-1-cyclopropanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1R,2R)-2-[(1R,4S,5S)-5-hydroxy-4-bicyclo[2.1.1]hexanyl]cyclopropane-1-carboxylate Traditional Name: (1R,2R)-2-[(1R,4S,5S)-5-hydroxy-4-bicyclo[2.1.1]hexanyl]cyclopropanecarboxylic acid benzyl ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1C2O)C3CC3C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C[C@]2(C[C@@H]1[C@@H]2O)[C@@H]3C[C@H]3C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C17H20O3/c18-15-12-6-7-17(15,9-12)14-8-13(14)16(19)20-10-11-4-2-1-3-5-11/h1-5,12-15,18H,6-10H2/t12-,13-,14-,15+,17+/m1/s1