dipotassium 5-hept-1-ynylbenzene-1,3-dicarboxylate

Systemtic Name: dipotassium 5-hept-1-ynylbenzene-1,3-dicarboxylate Openeye Name: dipotassium 5-hept-1-ynylbenzene-1,3-dicarboxylate CAS Name: dipotassium 5-hept-1-ynylbenzene-1,3-dicarboxylate IUPAC Name: dipotassium 5-hept-1-ynylbenzene-1,3-dicarboxylate Traditional Name: dipotassium 5-hept-1-ynylisophthalate Formula: C15H14K2O4 MolecularWeight: 336.46586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].[K+].[K+]

Isomeric SMILES

CCCCCC#CC1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].[K+].[K+]

InChI

InChI=1S/C15H16O4.2K/c1-2-3-4-5-6-7-11-8-12(14(16)17)10-13(9-11)15(18)19;;/h8-10H,2-5H2,1H3,(H,16,17)(H,18,19);;/q;2*+1/p-2