2-chloranyl-6-[(1R,5S)-3,3,5-trimethylcyclohexyl]oxy-benzoate

Systemtic Name: 2-chloranyl-6-[(1R,5S)-3,3,5-trimethylcyclohexyl]oxy-benzoate Openeye Name: 2-chloro-6-[(1R,5S)-3,3,5-trimethylcyclohexoxy]benzoate CAS Name: 2-chloro-6-[(1R,5S)-3,3,5-trimethylcyclohexyl]oxybenzoate IUPAC Name: 2-chloro-6-[(1R,5S)-3,3,5-trimethylcyclohexyl]oxybenzoate Traditional Name: 2-chloro-6-[(1R,5S)-3,3,5-trimethylcyclohexoxy]benzoate Formula: C16H20ClO3- MolecularWeight: 295.7812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OC2=C(C(=CC=C2)Cl)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H21ClO3/c1-10-7-11(9-16(2,3)8-10)20-13-6-4-5-12(17)14(13)15(18)19/h4-6,10-11H,7-9H2,1-3H3,(H,18,19)/p-1/t10-,11-/m1/s1