4-[[(1R,2S)-2-ethylcyclohexyl]oxymethyl]benzoate

Systemtic Name: 4-[[(1R,2S)-2-ethylcyclohexyl]oxymethyl]benzoate Openeye Name: 4-[[(1R,2S)-2-ethylcyclohexoxy]methyl]benzoate CAS Name: 4-[[(1R,2S)-2-ethylcyclohexyl]oxymethyl]benzoate IUPAC Name: 4-[[(1R,2S)-2-ethylcyclohexyl]oxymethyl]benzoate Traditional Name: 4-[[(1R,2S)-2-ethylcyclohexoxy]methyl]benzoate Formula: C16H21O3- MolecularWeight: 261.33614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCC1OCC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3/c1-2-13-5-3-4-6-15(13)19-11-12-7-9-14(10-8-12)16(17)18/h7-10,13,15H,2-6,11H2,1H3,(H,17,18)/p-1/t13-,15+/m0/s1