2-(bromomethyl)benzo[b][1]benzoxepine-5-carbonitrile

Systemtic Name: 2-(bromomethyl)benzo[b][1]benzoxepine-5-carbonitrile Openeye Name: 2-(bromomethyl)benzo[b][1]benzoxepine-5-carbonitrile CAS Name: 2-(bromomethyl)-5-benzo[b][1]benzoxepincarbonitrile IUPAC Name: 2-(bromomethyl)benzo[b][1]benzoxepine-5-carbonitrile Traditional Name: 2-(bromomethyl)benzo[b][1]benzoxepin-5-carbonitrile Formula: C16H10BrNO MolecularWeight: 312.1607

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=C(O2)C=C(C=C3)CBr)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=C(O2)C=C(C=C3)CBr)C#N

InChI

InChI=1S/C16H10BrNO/c17-9-11-5-6-14-13(10-18)8-12-3-1-2-4-15(12)19-16(14)7-11/h1-8H,9H2