N-(2-bromophenyl)-N'-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide

Systemtic Name: N-(2-bromophenyl)-N'-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide Openeye Name: N-(2-bromophenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]propanediamide CAS Name: N-(2-bromophenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide IUPAC Name: N-(2-bromophenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide Traditional Name: N-(2-bromophenyl)-N'-[(3-iodo-5-methoxy-4-propargyloxy-benzylidene)amino]malonamide Formula: C20H17BrIN3O4 MolecularWeight: 570.17515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2Br)I)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)CC(=O)NC2=CC=CC=C2Br)I)OCC#C

InChI

InChI=1S/C20H17BrIN3O4/c1-3-8-29-20-15(22)9-13(10-17(20)28-2)12-23-25-19(27)11-18(26)24-16-7-5-4-6-14(16)21/h1,4-7,9-10,12H,8,11H2,2H3,(H,24,26)(H,25,27)