sodium (4-chlorophenyl) 3,3-dimethyloxirane-2-carboxylate

Systemtic Name: sodium (4-chlorophenyl) 3,3-dimethyloxirane-2-carboxylate Openeye Name: sodium (4-chlorophenyl) 3,3-dimethyloxirane-2-carboxylate CAS Name: sodium 3,3-dimethyl-2-oxiranecarboxylic acid (4-chlorophenyl) ester IUPAC Name: sodium (4-chlorophenyl) 3,3-dimethyloxirane-2-carboxylate Traditional Name: sodium 3,3-dimethyloxirane-2-carboxylic acid (4-chlorophenyl) ester Formula: C11H11ClNaO3+ MolecularWeight: 249.64601

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(O1)C(=O)OC2=CC=C(C=C2)Cl)C.[Na+]

Isomeric SMILES

CC1(C(O1)C(=O)OC2=CC=C(C=C2)Cl)C.[Na+]

InChI

InChI=1S/C11H11ClO3.Na/c1-11(2)9(15-11)10(13)14-8-5-3-7(12)4-6-8;/h3-6,9H,1-2H3;/q;+1