(3S)-6-tert-butyl-N'-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: (3S)-6-tert-butyl-N'-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: (3S)-6-tert-butyl-N'-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: (3S)-6-tert-butyl-N'-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: (3S)-6-tert-butyl-N'-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: (3S)-6-tert-butyl-N'-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NNC=C3C=CC(=O)C(=C3)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC[C@H](O2)C(=O)NNC=C3C=CC(=O)C(=C3)O

InChI

InChI=1S/C20H22N2O5/c1-20(2,3)13-5-7-16-17(9-13)27-18(11-26-16)19(25)22-21-10-12-4-6-14(23)15(24)8-12/h4-10,18,21,24H,11H2,1-3H3,(H,22,25)/t18-/m0/s1