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

Systemtic Name: (3R)-6-tert-butyl-N'-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: (3R)-6-tert-butyl-N'-[(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: (3R)-6-tert-butyl-N'-[(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: (3R)-6-tert-butyl-N'-[(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: (3R)-6-tert-butyl-N'-[(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NNC=C3C=C(C=C(C3=O)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O7/c1-21(2,3)13-5-6-15-16(8-13)31-18(11-30-15)20(26)23-22-10-12-7-14(24(27)28)9-17(29-4)19(12)25/h5-10,18,22H,11H2,1-4H3,(H,23,26)/t18-/m1/s1