[(3-phenoxyphenyl)-prop-2-ynyl-alumanyl] ethanoate

Systemtic Name: [(3-phenoxyphenyl)-prop-2-ynyl-alumanyl] ethanoate Openeye Name: [(3-phenoxyphenyl)-prop-2-ynyl-alumanyl] acetate CAS Name: acetic acid [(3-phenoxyphenyl)-prop-2-ynylalumanyl] ester IUPAC Name: [(3-phenoxyphenyl)-prop-2-ynylalumanyl] acetate Traditional Name: acetic acid [(3-phenoxyphenyl)-propargyl-alumanyl] ester Formula: C17H15AlO3 MolecularWeight: 294.280738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O[Al](CC#C)C1=CC=CC(=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[Al](CC#C)C1=CC=CC(=C1)OC2=CC=CC=C2

InChI

InChI=1S/C12H9O.C3H3.C2H4O2.Al/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-2;1-2(3)4;/h1-5,7-10H;1H,2H2;1H3,(H,3,4);/q;;;+1/p-1