1-[(11E)-11-(3-bromanylpropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone

Systemtic Name: 1-[(11E)-11-(3-bromanylpropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone Openeye Name: 1-[(11E)-11-(3-bromopropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone CAS Name: 1-[(11E)-11-(3-bromopropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone IUPAC Name: 1-[(11E)-11-(3-bromopropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone Traditional Name: 1-[(11E)-11-(3-bromopropylidene)-5H-[1]benzoxepino[3,4-b]pyridin-9-yl]ethanone Formula: C18H16BrNO2 MolecularWeight: 358.22914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC3=C(C2=CCCBr)C=CC=N3

Isomeric SMILES

CC(=O)C1=CC\2=C(C=C1)OCC3=C(/C2=C\CCBr)C=CC=N3

InChI

InChI=1S/C18H16BrNO2/c1-12(21)13-6-7-18-16(10-13)14(4-2-8-19)15-5-3-9-20-17(15)11-22-18/h3-7,9-10H,2,8,11H2,1H3/b14-4+