(6-phenoxypyridin-2-yl)methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate

Systemtic Name: (6-phenoxypyridin-2-yl)methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate Openeye Name: (6-phenoxy-2-pyridyl)methyl 2-cyano-3-methyl-2-(2-naphthyl)butanoate CAS Name: 2-cyano-3-methyl-2-(2-naphthalenyl)butanoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl 2-cyano-3-methyl-2-naphthalen-2-ylbutanoate Traditional Name: 2-cyano-3-methyl-2-(2-naphthyl)butyric acid (6-phenoxy-2-pyridyl)methyl ester Formula: C28H24N2O3 MolecularWeight: 436.50176

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C28H24N2O3/c1-20(2)28(19-29,23-16-15-21-9-6-7-10-22(21)17-23)27(31)32-18-24-11-8-14-26(30-24)33-25-12-4-3-5-13-25/h3-17,20H,18H2,1-2H3