N-[(E)-(3-iodanyl-4,5-dimethoxy-phenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(E)-(3-iodanyl-4,5-dimethoxy-phenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-(3-iodo-4,5-dimethoxy-phenyl)methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-(3-iodo-4,5-dimethoxyphenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-(3-iodo-4,5-dimethoxyphenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-(3-iodo-4,5-dimethoxy-benzylidene)amino]-piperonylamide Formula: C17H15IN2O5 MolecularWeight: 454.21587

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C2=CC3=C(C=C2)OCO3)I)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC3=C(C=C2)OCO3)I)OC

InChI

InChI=1S/C17H15IN2O5/c1-22-15-6-10(5-12(18)16(15)23-2)8-19-20-17(21)11-3-4-13-14(7-11)25-9-24-13/h3-8H,9H2,1-2H3,(H,20,21)/b19-8+