2-(2-oxidanylidene-3,6-dipentyl-1,4-oxathian-3-yl)ethanoic acid

Systemtic Name: 2-(2-oxidanylidene-3,6-dipentyl-1,4-oxathian-3-yl)ethanoic acid Openeye Name: 2-(2-oxo-3,6-dipentyl-1,4-oxathian-3-yl)acetic acid CAS Name: 2-(2-oxo-3,6-dipentyl-1,4-oxathian-3-yl)acetic acid IUPAC Name: 2-(2-oxo-3,6-dipentyl-1,4-oxathian-3-yl)acetic acid Traditional Name: 2-(3,6-diamyl-2-keto-1,4-oxathian-3-yl)acetic acid Formula: C16H28O4S MolecularWeight: 316.45612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CSC(C(=O)O1)(CCCCC)CC(=O)O

Isomeric SMILES

CCCCCC1CSC(C(=O)O1)(CCCCC)CC(=O)O

InChI

InChI=1S/C16H28O4S/c1-3-5-7-9-13-12-21-16(11-14(17)18,15(19)20-13)10-8-6-4-2/h13H,3-12H2,1-2H3,(H,17,18)