5-(3-butyl-1,2-dithiolan-3-yl)pentanoate

Systemtic Name: 5-(3-butyl-1,2-dithiolan-3-yl)pentanoate Openeye Name: 5-(3-butyldithiolan-3-yl)pentanoate CAS Name: 5-(3-butyl-3-dithiolanyl)pentanoate IUPAC Name: 5-(3-butyldithiolan-3-yl)pentanoate Traditional Name: 5-(3-butyldithiolan-3-yl)valerate Formula: C12H21O2S2- MolecularWeight: 261.42394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCSS1)CCCCC(=O)[O-]

Isomeric SMILES

CCCCC1(CCSS1)CCCCC(=O)[O-]

InChI

InChI=1S/C12H22O2S2/c1-2-3-7-12(9-10-15-16-12)8-5-4-6-11(13)14/h2-10H2,1H3,(H,13,14)/p-1