lithium 4-(4-phenylbuta-1,3-diynyl)benzoate

Systemtic Name: lithium 4-(4-phenylbuta-1,3-diynyl)benzoate Openeye Name: lithium 4-(4-phenylbuta-1,3-diynyl)benzoate CAS Name: lithium 4-(4-phenylbuta-1,3-diynyl)benzoate IUPAC Name: lithium 4-(4-phenylbuta-1,3-diynyl)benzoate Traditional Name: lithium 4-(4-phenylbuta-1,3-diynyl)benzoate Formula: C17H9LiO2 MolecularWeight: 252.19316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10O2.Li/c18-17(19)16-12-10-15(11-13-16)9-5-4-8-14-6-2-1-3-7-14;/h1-3,6-7,10-13H,(H,18,19);/q;+1/p-1