1-[5-(1,2-dithiolan-3-yl)pentanoylamino]ethanesulfonic acid

Systemtic Name: 1-[5-(1,2-dithiolan-3-yl)pentanoylamino]ethanesulfonic acid Openeye Name: 1-[5-(dithiolan-3-yl)pentanoylamino]ethanesulfonic acid CAS Name: 1-[[5-(3-dithiolanyl)-1-oxopentyl]amino]ethanesulfonic acid IUPAC Name: 1-[5-(dithiolan-3-yl)pentanoylamino]ethanesulfonic acid Traditional Name: 1-[5-(dithiolan-3-yl)pentanoylamino]ethanesulfonic acid Formula: C10H19NO4S3 MolecularWeight: 313.45716

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)CCCCC1CCSS1)S(=O)(=O)O

Isomeric SMILES

CC(NC(=O)CCCCC1CCSS1)S(=O)(=O)O

InChI

InChI=1S/C10H19NO4S3/c1-8(18(13,14)15)11-10(12)5-3-2-4-9-6-7-16-17-9/h8-9H,2-7H2,1H3,(H,11,12)(H,13,14,15)