(2-cyano-3-phenoxy-phenyl)methyl 2-(4-chlorophenyl)-3-methyl-butanoate

Systemtic Name: (2-cyano-3-phenoxy-phenyl)methyl 2-(4-chlorophenyl)-3-methyl-butanoate Openeye Name: (2-cyano-3-phenoxy-phenyl)methyl 2-(4-chlorophenyl)-3-methyl-butanoate CAS Name: 2-(4-chlorophenyl)-3-methylbutanoic acid (2-cyano-3-phenoxyphenyl)methyl ester IUPAC Name: (2-cyano-3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-3-methylbutanoate Traditional Name: 2-(4-chlorophenyl)-3-methyl-butyric acid (2-cyano-3-phenoxy-benzyl) ester Formula: C25H22ClNO3 MolecularWeight: 419.90008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCC2=C(C(=CC=C2)OC3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCC2=C(C(=CC=C2)OC3=CC=CC=C3)C#N

InChI

InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)29-16-19-7-6-10-23(22(19)15-27)30-21-8-4-3-5-9-21/h3-14,17,24H,16H2,1-2H3