4-(2-bromanyl-4-tert-butyl-phenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]butanehydrazide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]butanehydrazide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]butanehydrazide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]butanehydrazide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]butanehydrazide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N'-[(E)-(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]butyrohydrazide Formula: C22H26BrN3O6 MolecularWeight: 508.36234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NNC=C2C=C(C(=O)C(=C2)OC)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NN/C=C/2\C=C(C(=O)C(=C2)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C22H26BrN3O6/c1-22(2,3)15-7-8-18(16(23)12-15)32-9-5-6-20(27)25-24-13-14-10-17(26(29)30)21(28)19(11-14)31-4/h7-8,10-13,24H,5-6,9H2,1-4H3,(H,25,27)/b14-13+