aluminum dicalcium ethyl 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: aluminum dicalcium ethyl 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: aluminum dicalcium ethyl 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: aluminum dicalcium 2-(4-chlorophenoxy)-2-methylpropanoic acid ethyl ester IUPAC Name: aluminum dicalcium ethyl 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: aluminum dicalcium 2-(4-chlorophenoxy)-2-methyl-propionic acid ethyl ester Formula: C12H15AlCa2ClO3+7 MolecularWeight: 349.836238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl.[Al+3].[Ca+2].[Ca+2]

Isomeric SMILES

CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl.[Al+3].[Ca+2].[Ca+2]

InChI

InChI=1S/C12H15ClO3.Al.2Ca/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10;;;/h5-8H,4H2,1-3H3;;;/q;+3;2*+2