2-[2-cyano-5-[(2,6-dimethylphenyl)methoxy]phenoxy]-2-(2-methylphenyl)ethanoic acid

Systemtic Name: 2-[2-cyano-5-[(2,6-dimethylphenyl)methoxy]phenoxy]-2-(2-methylphenyl)ethanoic acid Openeye Name: 2-[2-cyano-5-[(2,6-dimethylphenyl)methoxy]phenoxy]-2-(o-tolyl)acetic acid CAS Name: 2-[2-cyano-5-[(2,6-dimethylphenyl)methoxy]phenoxy]-2-(2-methylphenyl)acetic acid IUPAC Name: 2-[2-cyano-5-[(2,6-dimethylphenyl)methoxy]phenoxy]-2-(2-methylphenyl)acetic acid Traditional Name: 2-[2-cyano-5-(2,6-dimethylbenzyl)oxy-phenoxy]-2-(o-tolyl)acetic acid Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)COC2=CC(=C(C=C2)C#N)OC(C3=CC=CC=C3C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)COC2=CC(=C(C=C2)C#N)OC(C3=CC=CC=C3C)C(=O)O

InChI

InChI=1S/C25H23NO4/c1-16-7-4-5-10-21(16)24(25(27)28)30-23-13-20(12-11-19(23)14-26)29-15-22-17(2)8-6-9-18(22)3/h4-13,24H,15H2,1-3H3,(H,27,28)