1-[(3Z)-7-tert-butyl-5-iodanyl-3-(iodanylmethylidene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone

Systemtic Name: 1-[(3Z)-7-tert-butyl-5-iodanyl-3-(iodanylmethylidene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone Openeye Name: 1-[(3Z)-7-tert-butyl-5-iodo-3-(iodomethylene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone CAS Name: 1-[(3Z)-7-tert-butyl-5-iodo-3-(iodomethylidene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone IUPAC Name: 1-[(3Z)-7-tert-butyl-5-iodo-3-(iodomethylidene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone Traditional Name: 1-[(3Z)-7-tert-butyl-5-iodo-3-(iodomethylene)-4,5-dihydro-1-benzoxepin-4-yl]ethanone Formula: C17H20I2O2 MolecularWeight: 510.14844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C2=C(C=CC(=C2)C(C)(C)C)OCC1=CI)I

Isomeric SMILES

CC(=O)C\1C(C2=C(C=CC(=C2)C(C)(C)C)OC/C1=C\I)I

InChI

InChI=1S/C17H20I2O2/c1-10(20)15-11(8-18)9-21-14-6-5-12(17(2,3)4)7-13(14)16(15)19/h5-8,15-16H,9H2,1-4H3/b11-8+