3-oxidanylidene-3-thiophen-2-yl-2-undecan-5-yloxy-propanoic acid

Systemtic Name: 3-oxidanylidene-3-thiophen-2-yl-2-undecan-5-yloxy-propanoic acid Openeye Name: 2-(1-butylheptoxy)-3-oxo-3-(2-thienyl)propanoic acid CAS Name: 3-oxo-3-thiophen-2-yl-2-undecan-5-yloxypropanoic acid IUPAC Name: 3-oxo-3-thiophen-2-yl-2-undecan-5-yloxypropanoic acid Traditional Name: 2-(1-butylheptoxy)-3-keto-3-(2-thienyl)propionic acid Formula: C18H28O4S MolecularWeight: 340.47752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)OC(C(=O)C1=CC=CS1)C(=O)O

Isomeric SMILES

CCCCCCC(CCCC)OC(C(=O)C1=CC=CS1)C(=O)O

InChI

InChI=1S/C18H28O4S/c1-3-5-7-8-11-14(10-6-4-2)22-17(18(20)21)16(19)15-12-9-13-23-15/h9,12-14,17H,3-8,10-11H2,1-2H3,(H,20,21)