1-[(3E)-3-(chloranylmethylidene)-1-benzoxepin-7-yl]ethanone

Systemtic Name: 1-[(3E)-3-(chloranylmethylidene)-1-benzoxepin-7-yl]ethanone Openeye Name: 1-[(3E)-3-(chloromethylene)-1-benzoxepin-7-yl]ethanone CAS Name: 1-[(3E)-3-(chloromethylidene)-1-benzoxepin-7-yl]ethanone IUPAC Name: 1-[(3E)-3-(chloromethylidene)-1-benzoxepin-7-yl]ethanone Traditional Name: 1-[(3E)-3-(chloromethylene)-1-benzoxepin-7-yl]ethanone Formula: C13H11ClO2 MolecularWeight: 234.67824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=CCl)C=C2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC/C(=C/Cl)/C=C2

InChI

InChI=1S/C13H11ClO2/c1-9(15)11-4-5-13-12(6-11)3-2-10(7-14)8-16-13/h2-7H,8H2,1H3/b10-7+