methyl 3-cyano-4-[2-(2-phenylmethoxyphenyl)ethyl]benzoate

Systemtic Name: methyl 3-cyano-4-[2-(2-phenylmethoxyphenyl)ethyl]benzoate Openeye Name: methyl 4-[2-(2-benzyloxyphenyl)ethyl]-3-cyano-benzoate CAS Name: 3-cyano-4-[2-(2-phenylmethoxyphenyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 3-cyano-4-[2-(2-phenylmethoxyphenyl)ethyl]benzoate Traditional Name: 4-[2-(2-benzoxyphenyl)ethyl]-3-cyano-benzoic acid methyl ester Formula: C24H21NO3 MolecularWeight: 371.42844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)CCC2=CC=CC=C2OCC3=CC=CC=C3)C#N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)CCC2=CC=CC=C2OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C24H21NO3/c1-27-24(26)21-14-12-19(22(15-21)16-25)11-13-20-9-5-6-10-23(20)28-17-18-7-3-2-4-8-18/h2-10,12,14-15H,11,13,17H2,1H3