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

Systemtic Name: [(3E)-3-(chloranylmethylidene)-1-benzoxepin-7-yl]methyl ethanoate Openeye Name: [(3E)-3-(chloromethylene)-1-benzoxepin-7-yl]methyl acetate CAS Name: acetic acid [(3E)-3-(chloromethylidene)-1-benzoxepin-7-yl]methyl ester IUPAC Name: [(3E)-3-(chloromethylidene)-1-benzoxepin-7-yl]methyl acetate Traditional Name: acetic acid [(3E)-3-(chloromethylene)-1-benzoxepin-7-yl]methyl ester Formula: C14H13ClO3 MolecularWeight: 264.70422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC2=C(C=C1)OCC(=CCl)C=C2

Isomeric SMILES

CC(=O)OCC1=CC2=C(C=C1)OC/C(=C/Cl)/C=C2

InChI

InChI=1S/C14H13ClO3/c1-10(16)17-8-11-3-5-14-13(6-11)4-2-12(7-15)9-18-14/h2-7H,8-9H2,1H3/b12-7+