2-[4-[1-[3-(4-cyanophenyl)-2-methyl-phenyl]pentoxy]-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[1-[3-(4-cyanophenyl)-2-methyl-phenyl]pentoxy]-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[1-[3-(4-cyanophenyl)-2-methyl-phenyl]pentoxy]-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[1-[3-(4-cyanophenyl)-2-methylphenyl]pentoxy]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[1-[3-(4-cyanophenyl)-2-methylphenyl]pentoxy]-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[1-[3-(4-cyanophenyl)-2-methyl-phenyl]pentoxy]-2-methyl-phenoxy]acetic acid Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC(=C1C)C2=CC=C(C=C2)C#N)OC3=CC(=C(C=C3)OCC(=O)O)C

Isomeric SMILES

CCCCC(C1=CC=CC(=C1C)C2=CC=C(C=C2)C#N)OC3=CC(=C(C=C3)OCC(=O)O)C

InChI

InChI=1S/C28H29NO4/c1-4-5-9-27(33-23-14-15-26(19(2)16-23)32-18-28(30)31)25-8-6-7-24(20(25)3)22-12-10-21(17-29)11-13-22/h6-8,10-16,27H,4-5,9,18H2,1-3H3,(H,30,31)