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benzoic acid; hex-2-ynedioate

benzoic acid; hex-2-ynedioate

Systemtic Name:benzoic acid; hex-2-ynedioate
Openeye Name:benzoic acid; hex-2-ynedioate
CAS Name:benzoic acid; 2-hexynedioate
IUPAC Name:benzoic acid; hex-2-ynedioate
Traditional Name:benzoic acid; hex-2-ynedioate
Formula: C13H10O6-2
MolecularWeight: 262.2149
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)O.C(CC(=O)[O-])C#CC(=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)C(=O)O.C(CC(=O)[O-])C#CC(=O)[O-]


InChI

InChI=1S/C7H6O2.C6H6O4/c8-7(9)6-4-2-1-3-5-6;7-5(8)3-1-2-4-6(9)10/h1-5H,(H,8,9);1,3H2,(H,7,8)(H,9,10)/p-2


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