methyl 4-cyano-4-(4-cyanopyridin-3-yl)butanoate

Systemtic Name: methyl 4-cyano-4-(4-cyanopyridin-3-yl)butanoate Openeye Name: methyl 4-cyano-4-(4-cyano-3-pyridyl)butanoate CAS Name: 4-cyano-4-(4-cyano-3-pyridinyl)butanoic acid methyl ester IUPAC Name: methyl 4-cyano-4-(4-cyanopyridin-3-yl)butanoate Traditional Name: 4-cyano-4-(4-cyano-3-pyridyl)butyric acid methyl ester Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C#N)C1=C(C=CN=C1)C#N

Isomeric SMILES

COC(=O)CCC(C#N)C1=C(C=CN=C1)C#N

InChI

InChI=1S/C12H11N3O2/c1-17-12(16)3-2-9(6-13)11-8-15-5-4-10(11)7-14/h4-5,8-9H,2-3H2,1H3