(5-azanylidene-2-cyano-heptan-4-yl) ethanoate

Systemtic Name: (5-azanylidene-2-cyano-heptan-4-yl) ethanoate Openeye Name: [1-(2-cyanopropyl)-2-imino-butyl] acetate CAS Name: acetic acid (2-cyano-5-iminoheptan-4-yl) ester IUPAC Name: (2-cyano-5-iminoheptan-4-yl) acetate Traditional Name: acetic acid [1-(2-cyanopropyl)-2-imino-butyl] ester Formula: C10H16N2O2 MolecularWeight: 196.24624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=N)C(CC(C)C#N)OC(=O)C

Isomeric SMILES

CCC(=N)C(CC(C)C#N)OC(=O)C

InChI

InChI=1S/C10H16N2O2/c1-4-9(12)10(14-8(3)13)5-7(2)6-11/h7,10,12H,4-5H2,1-3H3