N-(3-chloranyl-4-methyl-phenyl)-N'-[(3,4-diethoxy-5-iodanyl-phenyl)methylideneamino]propanediamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-N'-[(3,4-diethoxy-5-iodanyl-phenyl)methylideneamino]propanediamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-N'-[(3,4-diethoxy-5-iodo-phenyl)methyleneamino]propanediamide CAS Name: N-(3-chloro-4-methylphenyl)-N'-[(3,4-diethoxy-5-iodophenyl)methylideneamino]propanediamide IUPAC Name: N-(3-chloro-4-methylphenyl)-N'-[(3,4-diethoxy-5-iodophenyl)methylideneamino]propanediamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-N'-[(3,4-diethoxy-5-iodo-benzylidene)amino]malonamide Formula: C21H23ClIN3O4 MolecularWeight: 543.78249

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC(=C(C=C2)C)Cl)I)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC(=C(C=C2)C)Cl)I)OCC

InChI

InChI=1S/C21H23ClIN3O4/c1-4-29-18-9-14(8-17(23)21(18)30-5-2)12-24-26-20(28)11-19(27)25-15-7-6-13(3)16(22)10-15/h6-10,12H,4-5,11H2,1-3H3,(H,25,27)(H,26,28)