N'-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]-1,3-benzodioxole-5-carbohydrazide Formula: C15H11N3O6 MolecularWeight: 329.26434

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O6/c19-12-3-1-9(5-11(12)18(21)22)7-16-17-15(20)10-2-4-13-14(6-10)24-8-23-13/h1-7,16H,8H2,(H,17,20)