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

Systemtic Name: [6-(4-methylphenoxy)pyridin-2-yl]methyl 2-cyano-3-methyl-2-naphthalen-2-yl-butanoate Openeye Name: [6-(4-methylphenoxy)-2-pyridyl]methyl 2-cyano-3-methyl-2-(2-naphthyl)butanoate CAS Name: 2-cyano-3-methyl-2-(2-naphthalenyl)butanoic acid [6-(4-methylphenoxy)-2-pyridinyl]methyl ester IUPAC Name: [6-(4-methylphenoxy)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-methylphenoxy)-2-pyridyl]methyl ester Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC(=N2)COC(=O)C(C#N)(C3=CC4=CC=CC=C4C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC(=N2)COC(=O)C(C#N)(C3=CC4=CC=CC=C4C=C3)C(C)C

InChI

InChI=1S/C29H26N2O3/c1-20(2)29(19-30,24-14-13-22-7-4-5-8-23(22)17-24)28(32)33-18-25-9-6-10-27(31-25)34-26-15-11-21(3)12-16-26/h4-17,20H,18H2,1-3H3