3-oxidanylidene-3-(5-tetradecylsulfanylfuran-2-yl)propanoic acid

Systemtic Name: 3-oxidanylidene-3-(5-tetradecylsulfanylfuran-2-yl)propanoic acid Openeye Name: 3-oxo-3-(5-tetradecylsulfanyl-2-furyl)propanoic acid CAS Name: 3-oxo-3-[5-(tetradecylthio)-2-furanyl]propanoic acid IUPAC Name: 3-oxo-3-(5-tetradecylsulfanylfuran-2-yl)propanoic acid Traditional Name: 3-keto-3-[5-(myristylthio)-2-furyl]propionic acid Formula: C21H34O4S MolecularWeight: 382.55726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCSC1=CC=C(O1)C(=O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCSC1=CC=C(O1)C(=O)CC(=O)O

InChI

InChI=1S/C21H34O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-26-21-15-14-19(25-21)18(22)17-20(23)24/h14-15H,2-13,16-17H2,1H3,(H,23,24)