(phenylmethyl) (1R,2R,3R,5R)-5-(2-chloranylpropan-2-yl)-2,3-dimethyl-3-oxidanyl-cyclopentane-1-carboxylate

Systemtic Name: (phenylmethyl) (1R,2R,3R,5R)-5-(2-chloranylpropan-2-yl)-2,3-dimethyl-3-oxidanyl-cyclopentane-1-carboxylate Openeye Name: benzyl (1R,2R,3R,5R)-5-(1-chloro-1-methyl-ethyl)-3-hydroxy-2,3-dimethyl-cyclopentanecarboxylate CAS Name: (1R,2R,3R,5R)-5-(2-chloropropan-2-yl)-3-hydroxy-2,3-dimethyl-1-cyclopentanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1R,2R,3R,5R)-5-(2-chloropropan-2-yl)-3-hydroxy-2,3-dimethylcyclopentane-1-carboxylate Traditional Name: (1R,2R,3R,5R)-5-(1-chloro-1-methyl-ethyl)-3-hydroxy-2,3-dimethyl-cyclopentanecarboxylic acid benzyl ester Formula: C18H25ClO3 MolecularWeight: 324.8423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC1(C)O)C(C)(C)Cl)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@H]([C@@H](C[C@@]1(C)O)C(C)(C)Cl)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25ClO3/c1-12-15(14(17(2,3)19)10-18(12,4)21)16(20)22-11-13-8-6-5-7-9-13/h5-9,12,14-15,21H,10-11H2,1-4H3/t12-,14-,15-,18-/m1/s1