(4-butanoyloxy-2,3-dicyano-phenyl) butanoate

Systemtic Name: (4-butanoyloxy-2,3-dicyano-phenyl) butanoate Openeye Name: (4-butanoyloxy-2,3-dicyano-phenyl) butanoate CAS Name: butanoic acid [2,3-dicyano-4-(1-oxobutoxy)phenyl] ester IUPAC Name: (4-butanoyloxy-2,3-dicyanophenyl) butanoate Traditional Name: butyric acid (4-butyryloxy-2,3-dicyano-phenyl) ester Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=C(C=C1)OC(=O)CCC)C#N)C#N

Isomeric SMILES

CCCC(=O)OC1=C(C(=C(C=C1)OC(=O)CCC)C#N)C#N

InChI

InChI=1S/C16H16N2O4/c1-3-5-15(19)21-13-7-8-14(22-16(20)6-4-2)12(10-18)11(13)9-17/h7-8H,3-6H2,1-2H3