[2-(4-cyanophenyl)pyrimidin-5-yl] butanoate

Systemtic Name: [2-(4-cyanophenyl)pyrimidin-5-yl] butanoate Openeye Name: [2-(4-cyanophenyl)pyrimidin-5-yl] butanoate CAS Name: butanoic acid [2-(4-cyanophenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-cyanophenyl)pyrimidin-5-yl] butanoate Traditional Name: butyric acid [2-(4-cyanophenyl)pyrimidin-5-yl] ester Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H13N3O2/c1-2-3-14(19)20-13-9-17-15(18-10-13)12-6-4-11(8-16)5-7-12/h4-7,9-10H,2-3H2,1H3