3-chloranyl-11-(6-iodanylhexanoyl)-5-methyl-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 3-chloranyl-11-(6-iodanylhexanoyl)-5-methyl-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-chloro-11-(6-iodohexanoyl)-5-methyl-benzo[b][1,4]benzodiazepin-6-one CAS Name: 3-chloro-11-(6-iodo-1-oxohexyl)-5-methyl-6-benzo[b][1,4]benzodiazepinone IUPAC Name: 3-chloro-11-(6-iodohexanoyl)-5-methylbenzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-chloro-11-(6-iodohexanoyl)-5-methyl-benzo[b][1,4]benzodiazepin-6-one Formula: C20H20ClIN2O2 MolecularWeight: 482.74247

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)Cl)N(C3=CC=CC=C3C1=O)C(=O)CCCCCI

Isomeric SMILES

CN1C2=C(C=CC(=C2)Cl)N(C3=CC=CC=C3C1=O)C(=O)CCCCCI

InChI

InChI=1S/C20H20ClIN2O2/c1-23-18-13-14(21)10-11-17(18)24(19(25)9-3-2-6-12-22)16-8-5-4-7-15(16)20(23)26/h4-5,7-8,10-11,13H,2-3,6,9,12H2,1H3