9-bromanyl-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile

Systemtic Name: 9-bromanyl-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile Openeye Name: 9-bromo-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile CAS Name: 9-bromo-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile IUPAC Name: 9-bromo-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile Traditional Name: 9-bromo-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine-11-carbonitrile Formula: C14H9BrN2O MolecularWeight: 301.13806

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC=N2)C(C3=C(O1)C=CC(=C3)Br)C#N

Isomeric SMILES

C1C2=C(C=CC=N2)C(C3=C(O1)C=CC(=C3)Br)C#N

InChI

InChI=1S/C14H9BrN2O/c15-9-3-4-14-11(6-9)12(7-16)10-2-1-5-17-13(10)8-18-14/h1-6,12H,8H2