5-[4-(4-cyanophenyl)phenoxy]-3-ethoxycarbonyl-pentanoic acid

Systemtic Name: 5-[4-(4-cyanophenyl)phenoxy]-3-ethoxycarbonyl-pentanoic acid Openeye Name: 5-[4-(4-cyanophenyl)phenoxy]-3-ethoxycarbonyl-pentanoic acid CAS Name: 5-[4-(4-cyanophenyl)phenoxy]-3-ethoxycarbonylpentanoic acid IUPAC Name: 5-[4-(4-cyanophenyl)phenoxy]-3-ethoxycarbonylpentanoic acid Traditional Name: 3-carbethoxy-5-[4-(4-cyanophenyl)phenoxy]valeric acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)CC(=O)O

Isomeric SMILES

CCOC(=O)C(CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)CC(=O)O

InChI

InChI=1S/C21H21NO5/c1-2-26-21(25)18(13-20(23)24)11-12-27-19-9-7-17(8-10-19)16-5-3-15(14-22)4-6-16/h3-10,18H,2,11-13H2,1H3,(H,23,24)