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

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 3-methyl-2-(4-propan-2-ylphenoxy)butanoate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 2-(4-isopropylphenoxy)-3-methyl-butanoate CAS Name: 3-methyl-2-(4-propan-2-ylphenoxy)butanoic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 3-methyl-2-(4-propan-2-ylphenoxy)butanoate Traditional Name: 2-(4-isopropylphenoxy)-3-methyl-butyric acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29NO4/c1-19(2)21-13-15-24(16-14-21)32-27(20(3)4)28(30)33-26(18-29)22-9-8-12-25(17-22)31-23-10-6-5-7-11-23/h5-17,19-20,26-27H,1-4H3