2-(11-oxidanylidene-6H-benzo[c][1]benzoxepin-9-yl)ethanenitrile

Systemtic Name: 2-(11-oxidanylidene-6H-benzo[c][1]benzoxepin-9-yl)ethanenitrile Openeye Name: 2-(11-oxo-6H-benzo[c][1]benzoxepin-9-yl)acetonitrile CAS Name: 2-(11-oxo-6H-benzo[c][1]benzoxepin-9-yl)acetonitrile IUPAC Name: 2-(11-oxo-6H-benzo[c][1]benzoxepin-9-yl)acetonitrile Traditional Name: 2-(11-keto-6H-benzo[c][1]benzoxepin-9-yl)acetonitrile Formula: C16H11NO2 MolecularWeight: 249.26404

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)CC#N)C(=O)C3=CC=CC=C3O1

Isomeric SMILES

C1C2=C(C=C(C=C2)CC#N)C(=O)C3=CC=CC=C3O1

InChI

InChI=1S/C16H11NO2/c17-8-7-11-5-6-12-10-19-15-4-2-1-3-13(15)16(18)14(12)9-11/h1-6,9H,7,10H2