ethyl 4-[4-cyano-3-(oxiran-2-ylmethoxymethyl)phenyl]benzoate

Systemtic Name: ethyl 4-[4-cyano-3-(oxiran-2-ylmethoxymethyl)phenyl]benzoate Openeye Name: ethyl 4-[4-cyano-3-(oxiran-2-ylmethoxymethyl)phenyl]benzoate CAS Name: 4-[4-cyano-3-(2-oxiranylmethoxymethyl)phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-cyano-3-(oxiran-2-ylmethoxymethyl)phenyl]benzoate Traditional Name: 4-[4-cyano-3-(glycidoxymethyl)phenyl]benzoic acid ethyl ester Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)COCC3CO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)COCC3CO3

InChI

InChI=1S/C20H19NO4/c1-2-24-20(22)15-5-3-14(4-6-15)16-7-8-17(10-21)18(9-16)11-23-12-19-13-25-19/h3-9,19H,2,11-13H2,1H3