2-(3-tert-butyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanenitrile

Systemtic Name: 2-(3-tert-butyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanenitrile Openeye Name: 2-(3-tert-butyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetonitrile CAS Name: 2-(3-tert-butyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetonitrile IUPAC Name: 2-(3-tert-butyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetonitrile Traditional Name: 2-(3-tert-butyl-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)acetonitrile Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=CC=CC=C2N(C1=O)CC#N

Isomeric SMILES

CC(C)(C)C1CCC2=CC=CC=C2N(C1=O)CC#N

InChI

InChI=1S/C16H20N2O/c1-16(2,3)13-9-8-12-6-4-5-7-14(12)18(11-10-17)15(13)19/h4-7,13H,8-9,11H2,1-3H3