4,4,5,5-tetraethoxypent-2-ynyl benzoate

Systemtic Name: 4,4,5,5-tetraethoxypent-2-ynyl benzoate Openeye Name: 4,4,5,5-tetraethoxypent-2-ynyl benzoate CAS Name: benzoic acid 4,4,5,5-tetraethoxypent-2-ynyl ester IUPAC Name: 4,4,5,5-tetraethoxypent-2-ynyl benzoate Traditional Name: benzoic acid 4,4,5,5-tetraethoxypent-2-ynyl ester Formula: C20H28O6 MolecularWeight: 364.43272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(C#CCOC(=O)C1=CC=CC=C1)(OCC)OCC)OCC

Isomeric SMILES

CCOC(C(C#CCOC(=O)C1=CC=CC=C1)(OCC)OCC)OCC

InChI

InChI=1S/C20H28O6/c1-5-22-19(23-6-2)20(25-7-3,26-8-4)15-12-16-24-18(21)17-13-10-9-11-14-17/h9-11,13-14,19H,5-8,16H2,1-4H3