[(2R,3R)-2,4-dimethyl-3-oxidanyl-pentyl] 4-methylbenzoate

Systemtic Name: [(2R,3R)-2,4-dimethyl-3-oxidanyl-pentyl] 4-methylbenzoate Openeye Name: [(2R,3R)-3-hydroxy-2,4-dimethyl-pentyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2R,3R)-3-hydroxy-2,4-dimethylpentyl] ester IUPAC Name: [(2R,3R)-3-hydroxy-2,4-dimethylpentyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2R,3R)-3-hydroxy-2,4-dimethyl-pentyl] ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(C)C(C(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC[C@@H](C)[C@@H](C(C)C)O

InChI

InChI=1S/C15H22O3/c1-10(2)14(16)12(4)9-18-15(17)13-7-5-11(3)6-8-13/h5-8,10,12,14,16H,9H2,1-4H3/t12-,14-/m1/s1