3-chloranyl-4,5-bis(prop-2-ynoxy)benzoate

Systemtic Name: 3-chloranyl-4,5-bis(prop-2-ynoxy)benzoate Openeye Name: 3-chloro-4,5-bis(prop-2-ynoxy)benzoate CAS Name: 3-chloro-4,5-bis(prop-2-ynoxy)benzoate IUPAC Name: 3-chloro-4,5-bis(prop-2-ynoxy)benzoate Traditional Name: 3-chloro-4,5-dipropargyloxy-benzoate Formula: C13H8ClO4- MolecularWeight: 263.65322

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCC#C

Isomeric SMILES

C#CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCC#C

InChI

InChI=1S/C13H9ClO4/c1-3-5-17-11-8-9(13(15)16)7-10(14)12(11)18-6-4-2/h1-2,7-8H,5-6H2,(H,15,16)/p-1