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

Systemtic Name: N'-[(3-iodanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-[(3-iodo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide CAS Name: N'-[(3-iodo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[(3-iodo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[(3-iodo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide Formula: C17H12IN3O5S MolecularWeight: 497.26375

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C=C(C1=O)I

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C=C(C1=O)I

InChI

InChI=1S/C17H12IN3O5S/c1-26-13-5-9(4-12(18)16(13)22)8-19-20-17(23)15-7-10-6-11(21(24)25)2-3-14(10)27-15/h2-8,19H,1H3,(H,20,23)