[(1S)-1-(1,3-thiazol-2-yl)octyl] benzoate

Systemtic Name: [(1S)-1-(1,3-thiazol-2-yl)octyl] benzoate Openeye Name: [(1S)-1-thiazol-2-yloctyl] benzoate CAS Name: benzoic acid [(1S)-1-(2-thiazolyl)octyl] ester IUPAC Name: [(1S)-1-(1,3-thiazol-2-yl)octyl] benzoate Traditional Name: benzoic acid [(1S)-1-thiazol-2-yloctyl] ester Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C1=NC=CS1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC[C@@H](C1=NC=CS1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H23NO2S/c1-2-3-4-5-9-12-16(17-19-13-14-22-17)21-18(20)15-10-7-6-8-11-15/h6-8,10-11,13-14,16H,2-5,9,12H2,1H3/t16-/m0/s1