2-[7-bromanyl-2-(iodanylmethyl)-5-nitro-2,3-dihydro-1-benzofuran-4-yl]ethanenitrile

Systemtic Name: 2-[7-bromanyl-2-(iodanylmethyl)-5-nitro-2,3-dihydro-1-benzofuran-4-yl]ethanenitrile Openeye Name: 2-[7-bromo-2-(iodomethyl)-5-nitro-2,3-dihydrobenzofuran-4-yl]acetonitrile CAS Name: 2-[7-bromo-2-(iodomethyl)-5-nitro-2,3-dihydrobenzofuran-4-yl]acetonitrile IUPAC Name: 2-[7-bromo-2-(iodomethyl)-5-nitro-2,3-dihydro-1-benzofuran-4-yl]acetonitrile Traditional Name: 2-[7-bromo-2-(iodomethyl)-5-nitro-coumaran-4-yl]acetonitrile Formula: C11H8BrIN2O3 MolecularWeight: 423.00129

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C=C(C(=C21)CC#N)[N+](=O)[O-])Br)CI

Isomeric SMILES

C1C(OC2=C(C=C(C(=C21)CC#N)[N+](=O)[O-])Br)CI

InChI

InChI=1S/C11H8BrIN2O3/c12-9-4-10(15(16)17)7(1-2-14)8-3-6(5-13)18-11(8)9/h4,6H,1,3,5H2