phenyl (1S,3S)-3-(bromomethyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate

Systemtic Name: phenyl (1S,3S)-3-(bromomethyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate Openeye Name: phenyl (1S,3S)-3-(bromomethyl)-1,2,2-trimethyl-cyclopentanecarboxylate CAS Name: (1S,3S)-3-(bromomethyl)-1,2,2-trimethyl-1-cyclopentanecarboxylic acid phenyl ester IUPAC Name: phenyl (1S,3S)-3-(bromomethyl)-1,2,2-trimethylcyclopentane-1-carboxylate Traditional Name: (1S,3S)-3-(bromomethyl)-1,2,2-trimethyl-cyclopentanecarboxylic acid phenyl ester Formula: C16H21BrO2 MolecularWeight: 325.24074

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)OC2=CC=CC=C2)CBr)C

Isomeric SMILES

C[C@@]1(CC[C@@H](C1(C)C)CBr)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C16H21BrO2/c1-15(2)12(11-17)9-10-16(15,3)14(18)19-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3/t12-,16-/m1/s1