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

Systemtic Name: N'-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-[(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide CAS Name: N'-[(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide Formula: C18H15N3O6S MolecularWeight: 401.3932

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O6S/c1-26-13-5-10(6-14(27-2)17(13)22)9-19-20-18(23)16-8-11-7-12(21(24)25)3-4-15(11)28-16/h3-9,19H,1-2H3,(H,20,23)