(3R)-N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: (3R)-N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: (3R)-N'-(5-bromo-2-oxo-indol-3-yl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: (3R)-N'-(5-bromo-2-oxo-3-indolyl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: (3R)-N'-(5-bromo-2-oxoindol-3-yl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: (3R)-N'-(5-bromo-2-keto-indol-3-yl)-6-tert-butyl-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NNC3=C4C=C(C=CC4=NC3=O)Br

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC[C@@H](O2)C(=O)NNC3=C4C=C(C=CC4=NC3=O)Br

InChI

InChI=1S/C21H20BrN3O4/c1-21(2,3)11-4-7-15-16(8-11)29-17(10-28-15)19(26)25-24-18-13-9-12(22)5-6-14(13)23-20(18)27/h4-9,17H,10H2,1-3H3,(H,25,26)(H,23,24,27)/t17-/m1/s1