2-[4-(4-cyanophenyl)phenoxy]-3-methyl-butanoic acid

Systemtic Name: 2-[4-(4-cyanophenyl)phenoxy]-3-methyl-butanoic acid Openeye Name: 2-[4-(4-cyanophenyl)phenoxy]-3-methyl-butanoic acid CAS Name: 2-[4-(4-cyanophenyl)phenoxy]-3-methylbutanoic acid IUPAC Name: 2-[4-(4-cyanophenyl)phenoxy]-3-methylbutanoic acid Traditional Name: 2-[4-(4-cyanophenyl)phenoxy]-3-methyl-butyric acid Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)C(C(=O)O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H17NO3/c1-12(2)17(18(20)21)22-16-9-7-15(8-10-16)14-5-3-13(11-19)4-6-14/h3-10,12,17H,1-2H3,(H,20,21)