methyl 4-cyano-4,4-dipyridin-2-yl-butanoate

Systemtic Name: methyl 4-cyano-4,4-dipyridin-2-yl-butanoate Openeye Name: methyl 4-cyano-4,4-bis(2-pyridyl)butanoate CAS Name: 4-cyano-4,4-bis(2-pyridinyl)butanoic acid methyl ester IUPAC Name: methyl 4-cyano-4,4-dipyridin-2-ylbutanoate Traditional Name: 4-cyano-4,4-bis(2-pyridyl)butyric acid methyl ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C#N)(C1=CC=CC=N1)C2=CC=CC=N2

Isomeric SMILES

COC(=O)CCC(C#N)(C1=CC=CC=N1)C2=CC=CC=N2

InChI

InChI=1S/C16H15N3O2/c1-21-15(20)8-9-16(12-17,13-6-2-4-10-18-13)14-7-3-5-11-19-14/h2-7,10-11H,8-9H2,1H3