[(3R)-3-(chloromethyl)-1-(1,3-dithian-2-yl)-2-oxidanylidene-pentan-3-yl] ethanoate

Systemtic Name: [(3R)-3-(chloromethyl)-1-(1,3-dithian-2-yl)-2-oxidanylidene-pentan-3-yl] ethanoate Openeye Name: [(1R)-1-(chloromethyl)-3-(1,3-dithian-2-yl)-1-ethyl-2-oxo-propyl] acetate CAS Name: acetic acid [(3R)-3-(chloromethyl)-1-(1,3-dithian-2-yl)-2-oxopentan-3-yl] ester IUPAC Name: [(3R)-3-(chloromethyl)-1-(1,3-dithian-2-yl)-2-oxopentan-3-yl] acetate Traditional Name: acetic acid [(1R)-1-(chloromethyl)-3-(1,3-dithian-2-yl)-1-ethyl-2-keto-propyl] ester Formula: C12H19ClO3S2 MolecularWeight: 310.86046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCl)(C(=O)CC1SCCCS1)OC(=O)C

Isomeric SMILES

CC[C@](CCl)(C(=O)CC1SCCCS1)OC(=O)C

InChI

InChI=1S/C12H19ClO3S2/c1-3-12(8-13,16-9(2)14)10(15)7-11-17-5-4-6-18-11/h11H,3-8H2,1-2H3/t12-/m0/s1