2-chloranyl-N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-nitro-benzamide Formula: C17H14Cl2N2O5 MolecularWeight: 397.20946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14Cl2N2O5/c18-13-8-11(21(23)24)2-3-12(13)17(22)20-9-10-6-14(19)16-15(7-10)25-4-1-5-26-16/h2-3,6-8H,1,4-5,9H2,(H,20,22)