dipotassium 5-(4-phenylbuta-1,3-diynyl)benzene-1,3-dicarboxylate

Systemtic Name: dipotassium 5-(4-phenylbuta-1,3-diynyl)benzene-1,3-dicarboxylate Openeye Name: dipotassium 5-(4-phenylbuta-1,3-diynyl)benzene-1,3-dicarboxylate CAS Name: dipotassium 5-(4-phenylbuta-1,3-diynyl)benzene-1,3-dicarboxylate IUPAC Name: dipotassium 5-(4-phenylbuta-1,3-diynyl)benzene-1,3-dicarboxylate Traditional Name: dipotassium 5-(4-phenylbuta-1,3-diynyl)isophthalate Formula: C18H8K2O4 MolecularWeight: 366.45032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC#CC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-].[K+].[K+]

Isomeric SMILES

C1=CC=C(C=C1)C#CC#CC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-].[K+].[K+]

InChI

InChI=1S/C18H10O4.2K/c19-17(20)15-10-14(11-16(12-15)18(21)22)9-5-4-8-13-6-2-1-3-7-13;;/h1-3,6-7,10-12H,(H,19,20)(H,21,22);;/q;2*+1/p-2