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

Systemtic Name: N-(2,4-dimethylphenyl)-N'-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]propanediamide Openeye Name: N-(2,4-dimethylphenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]propanediamide CAS Name: N-(2,4-dimethylphenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide IUPAC Name: N-(2,4-dimethylphenyl)-N'-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]propanediamide Traditional Name: N-(2,4-dimethylphenyl)-N'-[(3-iodo-5-methoxy-4-propargyloxy-benzylidene)amino]malonamide Formula: C22H22IN3O4 MolecularWeight: 519.33225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C(=C2)I)OCC#C)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CC(=O)NN=CC2=CC(=C(C(=C2)I)OCC#C)OC)C

InChI

InChI=1S/C22H22IN3O4/c1-5-8-30-22-17(23)10-16(11-19(22)29-4)13-24-26-21(28)12-20(27)25-18-7-6-14(2)9-15(18)3/h1,6-7,9-11,13H,8,12H2,2-4H3,(H,25,27)(H,26,28)