2-(2-chloranyl-4-nitro-phenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone Formula: C17H14ClNO6 MolecularWeight: 363.74916

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC1

InChI

InChI=1S/C17H14ClNO6/c18-13-9-12(19(21)22)3-5-15(13)25-10-14(20)11-2-4-16-17(8-11)24-7-1-6-23-16/h2-5,8-9H,1,6-7,10H2