sodium 2-methyl-2-(4-propan-2-ylphenoxy)-3-(2,4,6-trimethylphenyl)propanoate

Systemtic Name: sodium 2-methyl-2-(4-propan-2-ylphenoxy)-3-(2,4,6-trimethylphenyl)propanoate Openeye Name: sodium 2-(4-isopropylphenoxy)-2-methyl-3-(2,4,6-trimethylphenyl)propanoate CAS Name: sodium 2-methyl-2-(4-propan-2-ylphenoxy)-3-(2,4,6-trimethylphenyl)propanoate IUPAC Name: sodium 2-methyl-2-(4-propan-2-ylphenoxy)-3-(2,4,6-trimethylphenyl)propanoate Traditional Name: sodium 2-(4-isopropylphenoxy)-3-mesityl-2-methyl-propionate Formula: C22H27NaO3 MolecularWeight: 362.43775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(C)(C(=O)[O-])OC2=CC=C(C=C2)C(C)C)C.[Na+]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC(C)(C(=O)[O-])OC2=CC=C(C=C2)C(C)C)C.[Na+]

InChI

InChI=1S/C22H28O3.Na/c1-14(2)18-7-9-19(10-8-18)25-22(6,21(23)24)13-20-16(4)11-15(3)12-17(20)5;/h7-12,14H,13H2,1-6H3,(H,23,24);/q;+1/p-1