2-tert-butyl-4,7-dihydro-2H-oxepine-3,3-dicarbonitrile

Systemtic Name: 2-tert-butyl-4,7-dihydro-2H-oxepine-3,3-dicarbonitrile Openeye Name: 2-tert-butyl-4,7-dihydro-2H-oxepine-3,3-dicarbonitrile CAS Name: 2-tert-butyl-4,7-dihydro-2H-oxepin-3,3-dicarbonitrile IUPAC Name: 2-tert-butyl-4,7-dihydro-2H-oxepine-3,3-dicarbonitrile Traditional Name: 2-tert-butyl-4,7-dihydro-2H-oxepin-3,3-dicarbonitrile Formula: C12H16N2O MolecularWeight: 204.26824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(CC=CCO1)(C#N)C#N

Isomeric SMILES

CC(C)(C)C1C(CC=CCO1)(C#N)C#N

InChI

InChI=1S/C12H16N2O/c1-11(2,3)10-12(8-13,9-14)6-4-5-7-15-10/h4-5,10H,6-7H2,1-3H3