sodium 2-chloranyl-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate

Systemtic Name: sodium 2-chloranyl-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate Openeye Name: sodium 2-chloro-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate CAS Name: sodium 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate IUPAC Name: sodium 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate Traditional Name: sodium 2-chloro-3-(4-neophyloxyphenyl)propionate Formula: C19H20ClNaO3 MolecularWeight: 354.80307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=C(C=C1)CC(C(=O)[O-])Cl)C2=CC=CC=C2.[Na+]

Isomeric SMILES

CC(C)(COC1=CC=C(C=C1)CC(C(=O)[O-])Cl)C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C19H21ClO3.Na/c1-19(2,15-6-4-3-5-7-15)13-23-16-10-8-14(9-11-16)12-17(20)18(21)22;/h3-11,17H,12-13H2,1-2H3,(H,21,22);/q;+1/p-1