ethyl 3-[1-cyano-2-oxidanylidene-3-(4-phenoxyphenoxy)propyl]benzoate

Systemtic Name: ethyl 3-[1-cyano-2-oxidanylidene-3-(4-phenoxyphenoxy)propyl]benzoate Openeye Name: ethyl 3-[1-cyano-2-oxo-3-(4-phenoxyphenoxy)propyl]benzoate CAS Name: 3-[1-cyano-2-oxo-3-(4-phenoxyphenoxy)propyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[1-cyano-2-oxo-3-(4-phenoxyphenoxy)propyl]benzoate Traditional Name: 3-[1-cyano-2-keto-3-(4-phenoxyphenoxy)propyl]benzoic acid ethyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)C(C#N)C(=O)COC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)C(C#N)C(=O)COC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H21NO5/c1-2-29-25(28)19-8-6-7-18(15-19)23(16-26)24(27)17-30-20-11-13-22(14-12-20)31-21-9-4-3-5-10-21/h3-15,23H,2,17H2,1H3