sodium 2-methyl-2-(4-propan-2-ylphenoxy)-3-(4-propylphenyl)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CC(C)(C(=O)[O-])OC2=CC=C(C=C2)C(C)C.[Na+]

Isomeric SMILES

CCCC1=CC=C(C=C1)CC(C)(C(=O)[O-])OC2=CC=C(C=C2)C(C)C.[Na+]

InChI

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