sodium 2-chloranyl-3-[4-(2,2-dimethylpropoxy)phenyl]propanoate

Systemtic Name: sodium 2-chloranyl-3-[4-(2,2-dimethylpropoxy)phenyl]propanoate Openeye Name: sodium 2-chloro-3-[4-(2,2-dimethylpropoxy)phenyl]propanoate CAS Name: sodium 2-chloro-3-[4-(2,2-dimethylpropoxy)phenyl]propanoate IUPAC Name: sodium 2-chloro-3-[4-(2,2-dimethylpropoxy)phenyl]propanoate Traditional Name: sodium 2-chloro-3-(4-neopentyloxyphenyl)propionate Formula: C14H18ClNaO3 MolecularWeight: 292.73369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClO3.Na/c1-14(2,3)9-18-11-6-4-10(5-7-11)8-12(15)13(16)17;/h4-7,12H,8-9H2,1-3H3,(H,16,17);/q;+1/p-1