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

Systemtic Name: 5-nitro-N'-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1-benzothiophene-2-carbohydrazide Openeye Name: 5-nitro-N'-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzothiophene-2-carbohydrazide CAS Name: 5-nitro-N'-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1-benzothiophene-2-carbohydrazide IUPAC Name: 5-nitro-N'-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide Formula: C16H10N4O6S MolecularWeight: 386.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O6S/c21-13-3-1-9(5-12(13)20(25)26)8-17-18-16(22)15-7-10-6-11(19(23)24)2-4-14(10)27-15/h1-8,17H,(H,18,22)