2-[(2S)-octan-2-yl]oxybenzoate

Systemtic Name: 2-[(2S)-octan-2-yl]oxybenzoate Openeye Name: 2-[(1S)-1-methylheptoxy]benzoate CAS Name: 2-[(2S)-octan-2-yl]oxybenzoate IUPAC Name: 2-[(2S)-octan-2-yl]oxybenzoate Traditional Name: 2-[(1S)-1-methylheptoxy]benzoate Formula: C15H21O3- MolecularWeight: 249.32544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCC[C@H](C)OC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C15H22O3/c1-3-4-5-6-9-12(2)18-14-11-8-7-10-13(14)15(16)17/h7-8,10-12H,3-6,9H2,1-2H3,(H,16,17)/p-1/t12-/m0/s1