[cyano-(3-phenoxyphenyl)methyl] 2-[4-(2-methylpropyl)phenyl]ethanoate

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 2-[4-(2-methylpropyl)phenyl]ethanoate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 2-(4-isobutylphenyl)acetate CAS Name: 2-[4-(2-methylpropyl)phenyl]acetic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 2-[4-(2-methylpropyl)phenyl]acetate Traditional Name: 2-(4-isobutylphenyl)acetic acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)CC(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)CC(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H25NO3/c1-19(2)15-20-11-13-21(14-12-20)16-26(28)30-25(18-27)22-7-6-10-24(17-22)29-23-8-4-3-5-9-23/h3-14,17,19,25H,15-16H2,1-2H3