ethyl 2-cyanoethanoate; 1-iodanylbutane

Systemtic Name: ethyl 2-cyanoethanoate; 1-iodanylbutane Openeye Name: ethyl 2-cyanoacetate; 1-iodobutane CAS Name: 2-cyanoacetic acid ethyl ester; 1-iodobutane IUPAC Name: ethyl 2-cyanoacetate; 1-iodobutane Traditional Name: 2-cyanoacetic acid ethyl ester; 1-iodobutane Formula: C9H16INO2 MolecularWeight: 297.13331

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Descriptors Computed from Structure

Canonical SMILES:

CCCCI.CCOC(=O)CC#N

Isomeric SMILES

CCCCI.CCOC(=O)CC#N

InChI

InChI=1S/C5H7NO2.C4H9I/c1-2-8-5(7)3-4-6;1-2-3-4-5/h2-3H2,1H3;2-4H2,1H3