[6-(4-fluoranylphenoxy)pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate

Systemtic Name: [6-(4-fluoranylphenoxy)pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate Openeye Name: [6-(4-fluorophenoxy)-2-pyridyl]methyl 2-cyano-3-methyl-2-(2-naphthyl)butanoate CAS Name: 2-cyano-3-methyl-2-(2-naphthalenyl)butanoic acid [6-(4-fluorophenoxy)-2-pyridinyl]methyl ester IUPAC Name: [6-(4-fluorophenoxy)pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-ylbutanoate Traditional Name: 2-cyano-3-methyl-2-(2-naphthyl)butyric acid [6-(4-fluorophenoxy)-2-pyridyl]methyl ester Formula: C28H23FN2O3 MolecularWeight: 454.492223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(=O)OCC3=NC(=CC=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C(C#N)(C1=CC2=CC=CC=C2C=C1)C(=O)OCC3=NC(=CC=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C28H23FN2O3/c1-19(2)28(18-30,22-11-10-20-6-3-4-7-21(20)16-22)27(32)33-17-24-8-5-9-26(31-24)34-25-14-12-23(29)13-15-25/h3-16,19H,17H2,1-2H3