3-oxidanylidene-3-propoxy-2-(thiophen-2-ylmethyl)propanoic acid

Systemtic Name: 3-oxidanylidene-3-propoxy-2-(thiophen-2-ylmethyl)propanoic acid Openeye Name: 3-oxo-3-propoxy-2-(2-thienylmethyl)propanoic acid CAS Name: 3-oxo-3-propoxy-2-(thiophen-2-ylmethyl)propanoic acid IUPAC Name: 3-oxo-3-propoxy-2-(thiophen-2-ylmethyl)propanoic acid Traditional Name: 3-keto-3-propoxy-2-(2-thenyl)propionic acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CC1=CC=CS1)C(=O)O

Isomeric SMILES

CCCOC(=O)C(CC1=CC=CS1)C(=O)O

InChI

InChI=1S/C11H14O4S/c1-2-5-15-11(14)9(10(12)13)7-8-4-3-6-16-8/h3-4,6,9H,2,5,7H2,1H3,(H,12,13)