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

Systemtic Name: 4-[(1R,2S)-2-ethylcyclohexyl]oxybutanoate Openeye Name: 4-[(1R,2S)-2-ethylcyclohexoxy]butanoate CAS Name: 4-[(1R,2S)-2-ethylcyclohexyl]oxybutanoate IUPAC Name: 4-[(1R,2S)-2-ethylcyclohexyl]oxybutanoate Traditional Name: 4-[(1R,2S)-2-ethylcyclohexoxy]butyrate Formula: C12H21O3- MolecularWeight: 213.29334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCC1OCCCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H22O3/c1-2-10-6-3-4-7-11(10)15-9-5-8-12(13)14/h10-11H,2-9H2,1H3,(H,13,14)/p-1/t10-,11+/m0/s1