[cyano-(3-phenoxyphenyl)methyl] 2-(4-methoxyphenoxy)-3-methyl-butanoate

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 2-(4-methoxyphenoxy)-3-methyl-butanoate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 2-(4-methoxyphenoxy)-3-methyl-butanoate CAS Name: 2-(4-methoxyphenoxy)-3-methylbutanoic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 2-(4-methoxyphenoxy)-3-methylbutanoate Traditional Name: 2-(4-methoxyphenoxy)-3-methyl-butyric acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C26H25NO5 MolecularWeight: 431.4804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)OC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)OC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H25NO5/c1-18(2)25(31-22-14-12-20(29-3)13-15-22)26(28)32-24(17-27)19-8-7-11-23(16-19)30-21-9-5-4-6-10-21/h4-16,18,24-25H,1-3H3