ethyl 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)acetate CAS Name: 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)acetate Traditional Name: 2-cyano-2-(2,3,4,5-tetrahydro-1H-azepin-7-yl)acetic acid ethyl ester Formula: C11H16N2O2 MolecularWeight: 208.25694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=CCCCCN1

Isomeric SMILES

CCOC(=O)C(C#N)C1=CCCCCN1

InChI

InChI=1S/C11H16N2O2/c1-2-15-11(14)9(8-12)10-6-4-3-5-7-13-10/h6,9,13H,2-5,7H2,1H3