[2-(4-cyanophenyl)pyrimidin-5-yl]methyl oxirane-2-carboxylate

Systemtic Name: [2-(4-cyanophenyl)pyrimidin-5-yl]methyl oxirane-2-carboxylate Openeye Name: [2-(4-cyanophenyl)pyrimidin-5-yl]methyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid [2-(4-cyanophenyl)-5-pyrimidinyl]methyl ester IUPAC Name: [2-(4-cyanophenyl)pyrimidin-5-yl]methyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid [2-(4-cyanophenyl)pyrimidin-5-yl]methyl ester Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)C(=O)OCC2=CN=C(N=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1C(O1)C(=O)OCC2=CN=C(N=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C15H11N3O3/c16-5-10-1-3-12(4-2-10)14-17-6-11(7-18-14)8-21-15(19)13-9-20-13/h1-4,6-7,13H,8-9H2